USER MOD reduce.3.24.130724 H: found=0, std=0, add=914, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 913 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 16 THR OG1 : rot -130:sc= -0.955 USER MOD Set 1.2: C 125 DT C7 :methyl 150:sc= -1.81 (180deg=-0.928) USER MOD Single : A 1 LYS N :NH3+ -162:sc= -0.081 (180deg=-0.528) USER MOD Single : A 1 LYS NZ :NH3+ 157:sc= -0.167 (180deg=-0.749) USER MOD Single : A 5 THR OG1 : rot -96:sc= -2.22 USER MOD Single : A 8 SER OG : rot 75:sc= 1.01 USER MOD Single : A 9 ASN : amide:sc= -1.06 K(o=-1.1,f=-2.2!) USER MOD Single : A 11 GLN : amide:sc= -0.0364 K(o=-0.036,f=-1.5!) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 70:sc= 0.397 USER MOD Single : A 15 THR OG1 : rot -131:sc= 0.499 USER MOD Single : A 21 SER OG : rot -140:sc= -0.758 USER MOD Single : A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= -0.2 K(o=-0.2,f=-2.1) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 HIS : no HE2:sc= -4.17! C(o=-4.2!,f=-8.1!) USER MOD Single : A 39 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 41 ASN : amide:sc= -1.61 K(o=-1.6,f=-6.1!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 MET CE :methyl 161:sc= -0.371 (180deg=-0.599) USER MOD Single : A 48 LYS NZ :NH3+ -163:sc= -0.0266 (180deg=-0.301) USER MOD Single : A 52 GLN : amide:sc= -0.0853 X(o=-0.085,f=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.181 USER MOD Single : A 55 ASN : amide:sc= -0.983 K(o=-0.98,f=-7.6!) USER MOD Single : A 57 LYS NZ :NH3+ -133:sc= 0.366 (180deg=-2.52!) USER MOD Single : A 59 SER OG : rot 180:sc= 0.0013 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 150:sc= -0.3 (180deg=-1.53!) USER MOD Single : A 63 LYS NZ :NH3+ -129:sc= -1.72 (180deg=-4.32!) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 101 DG O5' : rot 180:sc= -0.195 USER MOD Single : B 102 DT C7 :methyl -30:sc= -0.348 (180deg=-1.26) USER MOD Single : B 103 DT C7 :methyl -30:sc= -1.77! (180deg=-2.16!) USER MOD Single : B 109 DT C7 :methyl 150:sc= -2.34 (180deg=-2.34) USER MOD Single : B 115 DT C7 :methyl -30:sc= -1 (180deg=-1.18) USER MOD Single : B 116 DT C7 :methyl 150:sc= -1.2 (180deg=-1.2) USER MOD Single : B 116 DT O3' : rot 180:sc= 0 USER MOD Single : C 117 DA O5' : rot 180:sc= -1.33 USER MOD Single : C 119 DT C7 :methyl -30:sc= -0.689 (180deg=-1.35!) USER MOD Single : C 121 DT C7 :methyl 150:sc= -0.767 (180deg=-0.767) USER MOD Single : C 122 DT C7 :methyl 150:sc= -1.56! (180deg=-1.56!) USER MOD Single : C 123 DT C7 :methyl -30:sc= -1.51! (180deg=-3.52!) USER MOD Single : C 127 DT C7 :methyl -30:sc= -1.09 (180deg=-1.16) USER MOD Single : C 132 DC O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 O5' DG B 101 18.929 23.381 7.114 1.00 0.00 O ATOM 2 C5' DG B 101 19.535 23.003 8.353 1.00 0.00 C ATOM 3 C4' DG B 101 18.603 22.123 9.191 1.00 0.00 C ATOM 4 O4' DG B 101 17.493 22.912 9.680 1.00 0.00 O ATOM 5 C3' DG B 101 18.031 20.956 8.378 1.00 0.00 C ATOM 6 O3' DG B 101 18.143 19.729 9.113 1.00 0.00 O ATOM 7 C2' DG B 101 16.580 21.304 8.151 1.00 0.00 C ATOM 8 C1' DG B 101 16.255 22.453 9.096 1.00 0.00 C ATOM 9 N9 DG B 101 15.563 23.552 8.389 1.00 0.00 N ATOM 10 C8 DG B 101 15.914 24.205 7.241 1.00 0.00 C ATOM 11 N7 DG B 101 15.102 25.152 6.874 1.00 0.00 N ATOM 12 C5 DG B 101 14.120 25.131 7.864 1.00 0.00 C ATOM 13 C6 DG B 101 12.958 25.936 8.016 1.00 0.00 C ATOM 14 O6 DG B 101 12.559 26.846 7.292 1.00 0.00 O ATOM 15 N1 DG B 101 12.240 25.585 9.153 1.00 0.00 N ATOM 16 C2 DG B 101 12.594 24.585 10.035 1.00 0.00 C ATOM 17 N2 DG B 101 11.772 24.384 11.065 1.00 0.00 N ATOM 18 N3 DG B 101 13.684 23.829 9.896 1.00 0.00 N ATOM 19 C4 DG B 101 14.397 24.155 8.795 1.00 0.00 C ATOM 0 H5' DG B 101 19.797 23.897 8.918 1.00 0.00 H new ATOM 0 H5'' DG B 101 20.463 22.467 8.156 1.00 0.00 H new ATOM 0 H4' DG B 101 19.195 21.724 10.015 1.00 0.00 H new ATOM 0 H3' DG B 101 18.567 20.812 7.440 1.00 0.00 H new ATOM 0 H2' DG B 101 16.409 21.595 7.114 1.00 0.00 H new ATOM 0 H2'' DG B 101 15.940 20.445 8.351 1.00 0.00 H new ATOM 0 HO5' DG B 101 19.549 23.943 6.605 1.00 0.00 H new ATOM 0 H1' DG B 101 15.577 22.108 9.877 1.00 0.00 H new ATOM 0 H8 DG B 101 16.801 23.953 6.679 1.00 0.00 H new ATOM 0 H1 DG B 101 11.386 26.107 9.350 1.00 0.00 H new ATOM 0 H21 DG B 101 11.981 23.658 11.750 1.00 0.00 H new ATOM 0 H22 DG B 101 10.934 24.956 11.168 1.00 0.00 H new ATOM 32 P DT B 102 17.577 18.338 8.518 1.00 0.00 P ATOM 33 OP1 DT B 102 18.415 17.236 9.044 1.00 0.00 O ATOM 34 OP2 DT B 102 17.398 18.494 7.057 1.00 0.00 O ATOM 35 O5' DT B 102 16.117 18.229 9.198 1.00 0.00 O ATOM 36 C5' DT B 102 15.997 18.190 10.623 1.00 0.00 C ATOM 37 C4' DT B 102 14.539 18.091 11.095 1.00 0.00 C ATOM 38 O4' DT B 102 13.836 19.337 10.848 1.00 0.00 O ATOM 39 C3' DT B 102 13.752 16.975 10.393 1.00 0.00 C ATOM 40 O3' DT B 102 13.261 16.032 11.352 1.00 0.00 O ATOM 41 C2' DT B 102 12.596 17.653 9.708 1.00 0.00 C ATOM 42 C1' DT B 102 12.547 19.068 10.246 1.00 0.00 C ATOM 43 N1 DT B 102 12.223 20.056 9.179 1.00 0.00 N ATOM 44 C2 DT B 102 11.080 20.831 9.329 1.00 0.00 C ATOM 45 O2 DT B 102 10.330 20.703 10.293 1.00 0.00 O ATOM 46 N3 DT B 102 10.833 21.755 8.332 1.00 0.00 N ATOM 47 C4 DT B 102 11.613 21.970 7.212 1.00 0.00 C ATOM 48 O4 DT B 102 11.298 22.818 6.383 1.00 0.00 O ATOM 49 C5 DT B 102 12.778 21.120 7.134 1.00 0.00 C ATOM 50 C7 DT B 102 13.727 21.271 5.943 1.00 0.00 C ATOM 51 C6 DT B 102 13.040 20.208 8.099 1.00 0.00 C ATOM 0 H5' DT B 102 16.451 19.086 11.046 1.00 0.00 H new ATOM 0 H5'' DT B 102 16.557 17.337 11.007 1.00 0.00 H new ATOM 0 H4' DT B 102 14.593 17.868 12.161 1.00 0.00 H new ATOM 0 H3' DT B 102 14.380 16.431 9.688 1.00 0.00 H new ATOM 0 H2' DT B 102 12.732 17.654 8.627 1.00 0.00 H new ATOM 0 H2'' DT B 102 11.663 17.128 9.911 1.00 0.00 H new ATOM 0 H1' DT B 102 11.752 19.164 10.985 1.00 0.00 H new ATOM 0 H3 DT B 102 9.998 22.332 8.432 1.00 0.00 H new ATOM 0 H71 DT B 102 13.166 21.605 5.071 1.00 0.00 H new ATOM 0 H72 DT B 102 14.497 22.005 6.182 1.00 0.00 H new ATOM 0 H73 DT B 102 14.195 20.311 5.727 1.00 0.00 H new ATOM 0 H6 DT B 102 13.918 19.585 8.011 1.00 0.00 H new ATOM 64 P DT B 103 12.397 14.752 10.890 1.00 0.00 P ATOM 65 OP1 DT B 103 12.531 13.699 11.919 1.00 0.00 O ATOM 66 OP2 DT B 103 12.724 14.457 9.477 1.00 0.00 O ATOM 67 O5' DT B 103 10.888 15.335 10.948 1.00 0.00 O ATOM 68 C5' DT B 103 10.372 15.825 12.193 1.00 0.00 C ATOM 69 C4' DT B 103 8.930 16.346 12.091 1.00 0.00 C ATOM 70 O4' DT B 103 8.885 17.591 11.353 1.00 0.00 O ATOM 71 C3' DT B 103 7.992 15.350 11.399 1.00 0.00 C ATOM 72 O3' DT B 103 6.953 14.963 12.294 1.00 0.00 O ATOM 73 C2' DT B 103 7.388 16.101 10.229 1.00 0.00 C ATOM 74 C1' DT B 103 7.831 17.556 10.368 1.00 0.00 C ATOM 75 N1 DT B 103 8.303 18.108 9.069 1.00 0.00 N ATOM 76 C2 DT B 103 7.655 19.217 8.540 1.00 0.00 C ATOM 77 O2 DT B 103 6.691 19.739 9.098 1.00 0.00 O ATOM 78 N3 DT B 103 8.158 19.703 7.348 1.00 0.00 N ATOM 79 C4 DT B 103 9.234 19.186 6.647 1.00 0.00 C ATOM 80 O4 DT B 103 9.598 19.694 5.590 1.00 0.00 O ATOM 81 C5 DT B 103 9.842 18.034 7.267 1.00 0.00 C ATOM 82 C7 DT B 103 11.042 17.371 6.581 1.00 0.00 C ATOM 83 C6 DT B 103 9.365 17.542 8.434 1.00 0.00 C ATOM 0 H5' DT B 103 11.016 16.627 12.555 1.00 0.00 H new ATOM 0 H5'' DT B 103 10.411 15.026 12.934 1.00 0.00 H new ATOM 0 H4' DT B 103 8.591 16.494 13.116 1.00 0.00 H new ATOM 0 H3' DT B 103 8.522 14.452 11.083 1.00 0.00 H new ATOM 0 H2' DT B 103 7.728 15.681 9.282 1.00 0.00 H new ATOM 0 H2'' DT B 103 6.301 16.024 10.239 1.00 0.00 H new ATOM 0 H1' DT B 103 6.990 18.175 10.680 1.00 0.00 H new ATOM 0 H3 DT B 103 7.693 20.518 6.948 1.00 0.00 H new ATOM 0 H71 DT B 103 10.964 17.505 5.502 1.00 0.00 H new ATOM 0 H72 DT B 103 11.964 17.830 6.938 1.00 0.00 H new ATOM 0 H73 DT B 103 11.052 16.306 6.815 1.00 0.00 H new ATOM 0 H6 DT B 103 9.840 16.677 8.873 1.00 0.00 H new ATOM 96 P DG B 104 5.914 13.803 11.902 1.00 0.00 P ATOM 97 OP1 DG B 104 5.358 13.237 13.152 1.00 0.00 O ATOM 98 OP2 DG B 104 6.560 12.915 10.911 1.00 0.00 O ATOM 99 O5' DG B 104 4.751 14.624 11.161 1.00 0.00 O ATOM 100 C5' DG B 104 4.037 15.651 11.849 1.00 0.00 C ATOM 101 C4' DG B 104 2.985 16.290 10.947 1.00 0.00 C ATOM 102 O4' DG B 104 3.633 17.057 9.906 1.00 0.00 O ATOM 103 C3' DG B 104 2.115 15.225 10.273 1.00 0.00 C ATOM 104 O3' DG B 104 0.730 15.562 10.392 1.00 0.00 O ATOM 105 C2' DG B 104 2.522 15.248 8.821 1.00 0.00 C ATOM 106 C1' DG B 104 3.264 16.558 8.601 1.00 0.00 C ATOM 107 N9 DG B 104 4.455 16.382 7.738 1.00 0.00 N ATOM 108 C8 DG B 104 5.455 15.449 7.797 1.00 0.00 C ATOM 109 N7 DG B 104 6.362 15.553 6.870 1.00 0.00 N ATOM 110 C5 DG B 104 5.931 16.648 6.123 1.00 0.00 C ATOM 111 C6 DG B 104 6.510 17.255 4.973 1.00 0.00 C ATOM 112 O6 DG B 104 7.537 16.937 4.378 1.00 0.00 O ATOM 113 N1 DG B 104 5.756 18.337 4.535 1.00 0.00 N ATOM 114 C2 DG B 104 4.590 18.780 5.123 1.00 0.00 C ATOM 115 N2 DG B 104 4.005 19.838 4.562 1.00 0.00 N ATOM 116 N3 DG B 104 4.045 18.212 6.201 1.00 0.00 N ATOM 117 C4 DG B 104 4.765 17.157 6.645 1.00 0.00 C ATOM 0 H5' DG B 104 4.735 16.413 12.195 1.00 0.00 H new ATOM 0 H5'' DG B 104 3.556 15.233 12.734 1.00 0.00 H new ATOM 0 H4' DG B 104 2.361 16.930 11.571 1.00 0.00 H new ATOM 0 H3' DG B 104 2.250 14.244 10.729 1.00 0.00 H new ATOM 0 H2' DG B 104 3.160 14.396 8.583 1.00 0.00 H new ATOM 0 H2'' DG B 104 1.649 15.183 8.172 1.00 0.00 H new ATOM 0 H1' DG B 104 2.623 17.269 8.080 1.00 0.00 H new ATOM 0 H8 DG B 104 5.489 14.683 8.557 1.00 0.00 H new ATOM 0 H1 DG B 104 6.091 18.843 3.715 1.00 0.00 H new ATOM 0 H21 DG B 104 3.140 20.210 4.954 1.00 0.00 H new ATOM 0 H22 DG B 104 4.422 20.276 3.741 1.00 0.00 H new ATOM 129 P DC B 105 -0.417 14.612 9.772 1.00 0.00 P ATOM 130 OP1 DC B 105 -1.652 14.814 10.558 1.00 0.00 O ATOM 131 OP2 DC B 105 0.150 13.250 9.634 1.00 0.00 O ATOM 132 O5' DC B 105 -0.672 15.193 8.287 1.00 0.00 O ATOM 133 C5' DC B 105 -1.110 16.542 8.102 1.00 0.00 C ATOM 134 C4' DC B 105 -1.295 16.900 6.618 1.00 0.00 C ATOM 135 O4' DC B 105 -0.022 16.991 5.928 1.00 0.00 O ATOM 136 C3' DC B 105 -2.145 15.854 5.883 1.00 0.00 C ATOM 137 O3' DC B 105 -3.289 16.485 5.300 1.00 0.00 O ATOM 138 C2' DC B 105 -1.256 15.280 4.807 1.00 0.00 C ATOM 139 C1' DC B 105 -0.052 16.200 4.715 1.00 0.00 C ATOM 140 N1 DC B 105 1.220 15.449 4.547 1.00 0.00 N ATOM 141 C2 DC B 105 1.998 15.712 3.423 1.00 0.00 C ATOM 142 O2 DC B 105 1.605 16.513 2.579 1.00 0.00 O ATOM 143 N3 DC B 105 3.187 15.065 3.294 1.00 0.00 N ATOM 144 C4 DC B 105 3.603 14.198 4.223 1.00 0.00 C ATOM 145 N4 DC B 105 4.773 13.584 4.062 1.00 0.00 N ATOM 146 C5 DC B 105 2.808 13.922 5.379 1.00 0.00 C ATOM 147 C6 DC B 105 1.629 14.566 5.492 1.00 0.00 C ATOM 0 H5' DC B 105 -0.384 17.221 8.549 1.00 0.00 H new ATOM 0 H5'' DC B 105 -2.052 16.691 8.629 1.00 0.00 H new ATOM 0 H4' DC B 105 -1.799 17.866 6.606 1.00 0.00 H new ATOM 0 H3' DC B 105 -2.505 15.076 6.556 1.00 0.00 H new ATOM 0 H2' DC B 105 -0.951 14.264 5.056 1.00 0.00 H new ATOM 0 H2'' DC B 105 -1.782 15.231 3.853 1.00 0.00 H new ATOM 0 H1' DC B 105 -0.145 16.834 3.834 1.00 0.00 H new ATOM 0 H41 DC B 105 5.102 12.920 4.764 1.00 0.00 H new ATOM 0 H42 DC B 105 5.341 13.777 3.237 1.00 0.00 H new ATOM 0 H5 DC B 105 3.140 13.224 6.133 1.00 0.00 H new ATOM 0 H6 DC B 105 1.000 14.376 6.349 1.00 0.00 H new ATOM 159 P DA B 106 -4.378 15.649 4.460 1.00 0.00 P ATOM 160 OP1 DA B 106 -5.706 16.258 4.696 1.00 0.00 O ATOM 161 OP2 DA B 106 -4.169 14.211 4.736 1.00 0.00 O ATOM 162 O5' DA B 106 -3.963 15.928 2.924 1.00 0.00 O ATOM 163 C5' DA B 106 -3.954 17.268 2.419 1.00 0.00 C ATOM 164 C4' DA B 106 -3.533 17.333 0.944 1.00 0.00 C ATOM 165 O4' DA B 106 -2.126 17.025 0.777 1.00 0.00 O ATOM 166 C3' DA B 106 -4.334 16.348 0.087 1.00 0.00 C ATOM 167 O3' DA B 106 -5.028 17.055 -0.933 1.00 0.00 O ATOM 168 C2' DA B 106 -3.318 15.418 -0.541 1.00 0.00 C ATOM 169 C1' DA B 106 -1.940 15.967 -0.197 1.00 0.00 C ATOM 170 N9 DA B 106 -1.080 14.912 0.349 1.00 0.00 N ATOM 171 C8 DA B 106 -1.314 14.143 1.425 1.00 0.00 C ATOM 172 N7 DA B 106 -0.373 13.307 1.733 1.00 0.00 N ATOM 173 C5 DA B 106 0.584 13.542 0.749 1.00 0.00 C ATOM 174 C6 DA B 106 1.838 12.974 0.491 1.00 0.00 C ATOM 175 N6 DA B 106 2.381 12.025 1.253 1.00 0.00 N ATOM 176 N1 DA B 106 2.518 13.432 -0.570 1.00 0.00 N ATOM 177 C2 DA B 106 2.000 14.391 -1.335 1.00 0.00 C ATOM 178 N3 DA B 106 0.824 15.001 -1.180 1.00 0.00 N ATOM 179 C4 DA B 106 0.163 14.519 -0.107 1.00 0.00 C ATOM 0 H5' DA B 106 -3.272 17.874 3.016 1.00 0.00 H new ATOM 0 H5'' DA B 106 -4.948 17.702 2.530 1.00 0.00 H new ATOM 0 H4' DA B 106 -3.730 18.354 0.619 1.00 0.00 H new ATOM 0 H3' DA B 106 -5.067 15.802 0.681 1.00 0.00 H new ATOM 0 H2' DA B 106 -3.436 14.404 -0.159 1.00 0.00 H new ATOM 0 H2'' DA B 106 -3.455 15.370 -1.621 1.00 0.00 H new ATOM 0 H1' DA B 106 -1.451 16.350 -1.092 1.00 0.00 H new ATOM 0 H8 DA B 106 -2.227 14.217 1.997 1.00 0.00 H new ATOM 0 H61 DA B 106 3.299 11.646 1.019 1.00 0.00 H new ATOM 0 H62 DA B 106 1.879 11.678 2.070 1.00 0.00 H new ATOM 0 H2 DA B 106 2.599 14.711 -2.175 1.00 0.00 H new ATOM 191 P DG B 107 -5.954 16.282 -1.988 1.00 0.00 P ATOM 192 OP1 DG B 107 -6.917 17.246 -2.566 1.00 0.00 O ATOM 193 OP2 DG B 107 -6.435 15.030 -1.364 1.00 0.00 O ATOM 194 O5' DG B 107 -4.866 15.911 -3.106 1.00 0.00 O ATOM 195 C5' DG B 107 -4.147 16.946 -3.766 1.00 0.00 C ATOM 196 C4' DG B 107 -3.113 16.382 -4.734 1.00 0.00 C ATOM 197 O4' DG B 107 -2.024 15.732 -4.017 1.00 0.00 O ATOM 198 C3' DG B 107 -3.726 15.340 -5.676 1.00 0.00 C ATOM 199 O3' DG B 107 -3.564 15.780 -7.026 1.00 0.00 O ATOM 200 C2' DG B 107 -2.959 14.069 -5.434 1.00 0.00 C ATOM 201 C1' DG B 107 -1.736 14.455 -4.631 1.00 0.00 C ATOM 202 N9 DG B 107 -1.371 13.410 -3.636 1.00 0.00 N ATOM 203 C8 DG B 107 -2.082 12.899 -2.575 1.00 0.00 C ATOM 204 N7 DG B 107 -1.473 11.987 -1.895 1.00 0.00 N ATOM 205 C5 DG B 107 -0.252 11.865 -2.534 1.00 0.00 C ATOM 206 C6 DG B 107 0.837 11.014 -2.232 1.00 0.00 C ATOM 207 O6 DG B 107 0.923 10.189 -1.328 1.00 0.00 O ATOM 208 N1 DG B 107 1.887 11.194 -3.118 1.00 0.00 N ATOM 209 C2 DG B 107 1.889 12.083 -4.172 1.00 0.00 C ATOM 210 N2 DG B 107 2.991 12.103 -4.923 1.00 0.00 N ATOM 211 N3 DG B 107 0.861 12.891 -4.460 1.00 0.00 N ATOM 212 C4 DG B 107 -0.173 12.728 -3.601 1.00 0.00 C ATOM 0 H5' DG B 107 -3.650 17.573 -3.026 1.00 0.00 H new ATOM 0 H5'' DG B 107 -4.844 17.585 -4.309 1.00 0.00 H new ATOM 0 H4' DG B 107 -2.742 17.230 -5.309 1.00 0.00 H new ATOM 0 H3' DG B 107 -4.791 15.191 -5.500 1.00 0.00 H new ATOM 0 H2' DG B 107 -3.567 13.345 -4.891 1.00 0.00 H new ATOM 0 H2'' DG B 107 -2.673 13.602 -6.377 1.00 0.00 H new ATOM 0 H1' DG B 107 -0.862 14.540 -5.276 1.00 0.00 H new ATOM 0 H8 DG B 107 -3.078 13.237 -2.329 1.00 0.00 H new ATOM 0 H1 DG B 107 2.722 10.625 -2.980 1.00 0.00 H new ATOM 0 H21 DG B 107 3.055 12.739 -5.718 1.00 0.00 H new ATOM 0 H22 DG B 107 3.770 11.482 -4.702 1.00 0.00 H new ATOM 224 P DA B 108 -4.097 14.918 -8.275 1.00 0.00 P ATOM 225 OP1 DA B 108 -4.536 15.859 -9.329 1.00 0.00 O ATOM 226 OP2 DA B 108 -5.034 13.895 -7.763 1.00 0.00 O ATOM 227 O5' DA B 108 -2.763 14.168 -8.798 1.00 0.00 O ATOM 228 C5' DA B 108 -1.643 14.947 -9.235 1.00 0.00 C ATOM 229 C4' DA B 108 -0.458 14.086 -9.699 1.00 0.00 C ATOM 230 O4' DA B 108 0.173 13.410 -8.576 1.00 0.00 O ATOM 231 C3' DA B 108 -0.894 13.012 -10.700 1.00 0.00 C ATOM 232 O3' DA B 108 -0.070 13.087 -11.876 1.00 0.00 O ATOM 233 C2' DA B 108 -0.719 11.698 -9.981 1.00 0.00 C ATOM 234 C1' DA B 108 0.189 11.977 -8.797 1.00 0.00 C ATOM 235 N9 DA B 108 -0.243 11.247 -7.584 1.00 0.00 N ATOM 236 C8 DA B 108 -1.453 11.262 -6.950 1.00 0.00 C ATOM 237 N7 DA B 108 -1.504 10.606 -5.833 1.00 0.00 N ATOM 238 C5 DA B 108 -0.215 10.096 -5.710 1.00 0.00 C ATOM 239 C6 DA B 108 0.392 9.301 -4.738 1.00 0.00 C ATOM 240 N6 DA B 108 -0.230 8.914 -3.628 1.00 0.00 N ATOM 241 N1 DA B 108 1.678 8.964 -4.927 1.00 0.00 N ATOM 242 C2 DA B 108 2.333 9.391 -6.005 1.00 0.00 C ATOM 243 N3 DA B 108 1.856 10.158 -6.983 1.00 0.00 N ATOM 244 C4 DA B 108 0.560 10.474 -6.770 1.00 0.00 C ATOM 0 H5' DA B 108 -1.318 15.594 -8.421 1.00 0.00 H new ATOM 0 H5'' DA B 108 -1.956 15.596 -10.053 1.00 0.00 H new ATOM 0 H4' DA B 108 0.245 14.770 -10.174 1.00 0.00 H new ATOM 0 H3' DA B 108 -1.925 13.137 -11.031 1.00 0.00 H new ATOM 0 H2' DA B 108 -1.680 11.305 -9.650 1.00 0.00 H new ATOM 0 H2'' DA B 108 -0.279 10.950 -10.640 1.00 0.00 H new ATOM 0 H1' DA B 108 1.199 11.628 -9.012 1.00 0.00 H new ATOM 0 H8 DA B 108 -2.308 11.785 -7.352 1.00 0.00 H new ATOM 0 H61 DA B 108 0.257 8.332 -2.947 1.00 0.00 H new ATOM 0 H62 DA B 108 -1.195 9.199 -3.458 1.00 0.00 H new ATOM 0 H2 DA B 108 3.364 9.081 -6.096 1.00 0.00 H new ATOM 256 P DT B 109 -0.269 12.088 -13.130 1.00 0.00 P ATOM 257 OP1 DT B 109 0.012 12.846 -14.369 1.00 0.00 O ATOM 258 OP2 DT B 109 -1.569 11.401 -12.968 1.00 0.00 O ATOM 259 O5' DT B 109 0.903 10.996 -12.934 1.00 0.00 O ATOM 260 C5' DT B 109 2.272 11.426 -12.930 1.00 0.00 C ATOM 261 C4' DT B 109 3.259 10.269 -12.734 1.00 0.00 C ATOM 262 O4' DT B 109 3.166 9.764 -11.386 1.00 0.00 O ATOM 263 C3' DT B 109 3.008 9.103 -13.705 1.00 0.00 C ATOM 264 O3' DT B 109 4.165 8.866 -14.513 1.00 0.00 O ATOM 265 C2' DT B 109 2.746 7.900 -12.831 1.00 0.00 C ATOM 266 C1' DT B 109 2.991 8.335 -11.389 1.00 0.00 C ATOM 267 N1 DT B 109 1.858 7.941 -10.512 1.00 0.00 N ATOM 268 C2 DT B 109 2.117 7.097 -9.444 1.00 0.00 C ATOM 269 O2 DT B 109 3.239 6.644 -9.226 1.00 0.00 O ATOM 270 N3 DT B 109 1.040 6.785 -8.643 1.00 0.00 N ATOM 271 C4 DT B 109 -0.256 7.231 -8.808 1.00 0.00 C ATOM 272 O4 DT B 109 -1.136 6.899 -8.025 1.00 0.00 O ATOM 273 C5 DT B 109 -0.443 8.097 -9.944 1.00 0.00 C ATOM 274 C7 DT B 109 -1.853 8.620 -10.241 1.00 0.00 C ATOM 275 C6 DT B 109 0.601 8.421 -10.746 1.00 0.00 C ATOM 0 H5' DT B 109 2.415 12.158 -12.135 1.00 0.00 H new ATOM 0 H5'' DT B 109 2.492 11.930 -13.871 1.00 0.00 H new ATOM 0 H4' DT B 109 4.252 10.672 -12.934 1.00 0.00 H new ATOM 0 H3' DT B 109 2.177 9.316 -14.377 1.00 0.00 H new ATOM 0 H2' DT B 109 1.723 7.546 -12.959 1.00 0.00 H new ATOM 0 H2'' DT B 109 3.405 7.075 -13.102 1.00 0.00 H new ATOM 0 H1' DT B 109 3.881 7.843 -10.997 1.00 0.00 H new ATOM 0 H3 DT B 109 1.217 6.165 -7.853 1.00 0.00 H new ATOM 0 H71 DT B 109 -1.785 9.597 -10.719 1.00 0.00 H new ATOM 0 H72 DT B 109 -2.366 7.925 -10.906 1.00 0.00 H new ATOM 0 H73 DT B 109 -2.412 8.710 -9.309 1.00 0.00 H new ATOM 0 H6 DT B 109 0.435 9.074 -11.590 1.00 0.00 H new ATOM 288 P DA B 110 4.143 7.812 -15.739 1.00 0.00 P ATOM 289 OP1 DA B 110 5.245 8.155 -16.667 1.00 0.00 O ATOM 290 OP2 DA B 110 2.755 7.719 -16.245 1.00 0.00 O ATOM 291 O5' DA B 110 4.510 6.416 -15.019 1.00 0.00 O ATOM 292 C5' DA B 110 5.752 6.266 -14.331 1.00 0.00 C ATOM 293 C4' DA B 110 5.901 4.881 -13.690 1.00 0.00 C ATOM 294 O4' DA B 110 4.945 4.746 -12.599 1.00 0.00 O ATOM 295 C3' DA B 110 5.618 3.736 -14.669 1.00 0.00 C ATOM 296 O3' DA B 110 6.649 2.748 -14.558 1.00 0.00 O ATOM 297 C2' DA B 110 4.290 3.156 -14.269 1.00 0.00 C ATOM 298 C1' DA B 110 3.989 3.687 -12.880 1.00 0.00 C ATOM 299 N9 DA B 110 2.594 4.177 -12.791 1.00 0.00 N ATOM 300 C8 DA B 110 1.925 5.030 -13.622 1.00 0.00 C ATOM 301 N7 DA B 110 0.696 5.278 -13.285 1.00 0.00 N ATOM 302 C5 DA B 110 0.529 4.526 -12.126 1.00 0.00 C ATOM 303 C6 DA B 110 -0.559 4.348 -11.265 1.00 0.00 C ATOM 304 N6 DA B 110 -1.734 4.951 -11.448 1.00 0.00 N ATOM 305 N1 DA B 110 -0.390 3.532 -10.209 1.00 0.00 N ATOM 306 C2 DA B 110 0.783 2.928 -10.011 1.00 0.00 C ATOM 307 N3 DA B 110 1.877 3.029 -10.764 1.00 0.00 N ATOM 308 C4 DA B 110 1.676 3.852 -11.815 1.00 0.00 C ATOM 0 H5' DA B 110 5.831 7.031 -13.559 1.00 0.00 H new ATOM 0 H5'' DA B 110 6.573 6.431 -15.029 1.00 0.00 H new ATOM 0 H4' DA B 110 6.935 4.811 -13.351 1.00 0.00 H new ATOM 0 H3' DA B 110 5.596 4.082 -15.702 1.00 0.00 H new ATOM 0 H2' DA B 110 3.511 3.448 -14.973 1.00 0.00 H new ATOM 0 H2'' DA B 110 4.327 2.067 -14.268 1.00 0.00 H new ATOM 0 H1' DA B 110 4.085 2.893 -12.139 1.00 0.00 H new ATOM 0 H8 DA B 110 2.385 5.467 -14.496 1.00 0.00 H new ATOM 0 H61 DA B 110 -2.498 4.789 -10.792 1.00 0.00 H new ATOM 0 H62 DA B 110 -1.869 5.574 -12.244 1.00 0.00 H new ATOM 0 H2 DA B 110 0.853 2.287 -9.145 1.00 0.00 H new ATOM 320 P DA B 111 6.641 1.411 -15.458 1.00 0.00 P ATOM 321 OP1 DA B 111 8.040 1.046 -15.770 1.00 0.00 O ATOM 322 OP2 DA B 111 5.659 1.594 -16.549 1.00 0.00 O ATOM 323 O5' DA B 111 6.049 0.324 -14.419 1.00 0.00 O ATOM 324 C5' DA B 111 6.763 0.076 -13.202 1.00 0.00 C ATOM 325 C4' DA B 111 6.003 -0.829 -12.221 1.00 0.00 C ATOM 326 O4' DA B 111 4.758 -0.216 -11.811 1.00 0.00 O ATOM 327 C3' DA B 111 5.684 -2.208 -12.811 1.00 0.00 C ATOM 328 O3' DA B 111 6.280 -3.217 -12.001 1.00 0.00 O ATOM 329 C2' DA B 111 4.178 -2.336 -12.770 1.00 0.00 C ATOM 330 C1' DA B 111 3.652 -1.126 -12.009 1.00 0.00 C ATOM 331 N9 DA B 111 2.574 -0.473 -12.768 1.00 0.00 N ATOM 332 C8 DA B 111 2.628 0.057 -14.017 1.00 0.00 C ATOM 333 N7 DA B 111 1.520 0.576 -14.447 1.00 0.00 N ATOM 334 C5 DA B 111 0.644 0.371 -13.384 1.00 0.00 C ATOM 335 C6 DA B 111 -0.704 0.687 -13.197 1.00 0.00 C ATOM 336 N6 DA B 111 -1.439 1.306 -14.121 1.00 0.00 N ATOM 337 N1 DA B 111 -1.265 0.340 -12.025 1.00 0.00 N ATOM 338 C2 DA B 111 -0.540 -0.284 -11.092 1.00 0.00 C ATOM 339 N3 DA B 111 0.743 -0.629 -11.170 1.00 0.00 N ATOM 340 C4 DA B 111 1.277 -0.267 -12.355 1.00 0.00 C ATOM 0 H5' DA B 111 6.977 1.027 -12.715 1.00 0.00 H new ATOM 0 H5'' DA B 111 7.722 -0.384 -13.440 1.00 0.00 H new ATOM 0 H4' DA B 111 6.666 -0.960 -11.366 1.00 0.00 H new ATOM 0 H3' DA B 111 6.067 -2.318 -13.826 1.00 0.00 H new ATOM 0 H2' DA B 111 3.765 -2.367 -13.778 1.00 0.00 H new ATOM 0 H2'' DA B 111 3.882 -3.261 -12.276 1.00 0.00 H new ATOM 0 H1' DA B 111 3.239 -1.431 -11.048 1.00 0.00 H new ATOM 0 H8 DA B 111 3.530 0.047 -14.611 1.00 0.00 H new ATOM 0 H61 DA B 111 -2.420 1.515 -13.936 1.00 0.00 H new ATOM 0 H62 DA B 111 -1.020 1.571 -15.013 1.00 0.00 H new ATOM 0 H2 DA B 111 -1.051 -0.536 -10.174 1.00 0.00 H new ATOM 352 P DA B 112 6.135 -4.782 -12.343 1.00 0.00 P ATOM 353 OP1 DA B 112 7.212 -5.518 -11.643 1.00 0.00 O ATOM 354 OP2 DA B 112 5.967 -4.927 -13.807 1.00 0.00 O ATOM 355 O5' DA B 112 4.733 -5.127 -11.635 1.00 0.00 O ATOM 356 C5' DA B 112 4.579 -4.937 -10.228 1.00 0.00 C ATOM 357 C4' DA B 112 3.140 -5.195 -9.770 1.00 0.00 C ATOM 358 O4' DA B 112 2.248 -4.225 -10.394 1.00 0.00 O ATOM 359 C3' DA B 112 2.646 -6.591 -10.171 1.00 0.00 C ATOM 360 O3' DA B 112 2.041 -7.236 -9.043 1.00 0.00 O ATOM 361 C2' DA B 112 1.632 -6.369 -11.258 1.00 0.00 C ATOM 362 C1' DA B 112 1.239 -4.906 -11.181 1.00 0.00 C ATOM 363 N9 DA B 112 1.086 -4.320 -12.536 1.00 0.00 N ATOM 364 C8 DA B 112 1.930 -4.376 -13.611 1.00 0.00 C ATOM 365 N7 DA B 112 1.500 -3.778 -14.682 1.00 0.00 N ATOM 366 C5 DA B 112 0.262 -3.279 -14.289 1.00 0.00 C ATOM 367 C6 DA B 112 -0.718 -2.543 -14.963 1.00 0.00 C ATOM 368 N6 DA B 112 -0.605 -2.176 -16.239 1.00 0.00 N ATOM 369 N1 DA B 112 -1.827 -2.217 -14.276 1.00 0.00 N ATOM 370 C2 DA B 112 -1.962 -2.594 -13.004 1.00 0.00 C ATOM 371 N3 DA B 112 -1.097 -3.289 -12.275 1.00 0.00 N ATOM 372 C4 DA B 112 0.002 -3.601 -12.986 1.00 0.00 C ATOM 0 H5' DA B 112 4.866 -3.919 -9.966 1.00 0.00 H new ATOM 0 H5'' DA B 112 5.255 -5.606 -9.695 1.00 0.00 H new ATOM 0 H4' DA B 112 3.134 -5.111 -8.683 1.00 0.00 H new ATOM 0 H3' DA B 112 3.460 -7.230 -10.513 1.00 0.00 H new ATOM 0 H2' DA B 112 2.051 -6.608 -12.235 1.00 0.00 H new ATOM 0 H2'' DA B 112 0.764 -7.013 -11.117 1.00 0.00 H new ATOM 0 H1' DA B 112 0.267 -4.792 -10.701 1.00 0.00 H new ATOM 0 H8 DA B 112 2.884 -4.880 -13.573 1.00 0.00 H new ATOM 0 H61 DA B 112 -1.350 -1.639 -16.683 1.00 0.00 H new ATOM 0 H62 DA B 112 0.227 -2.432 -16.771 1.00 0.00 H new ATOM 0 H2 DA B 112 -2.878 -2.301 -12.512 1.00 0.00 H new ATOM 384 P DC B 113 1.425 -8.723 -9.155 1.00 0.00 P ATOM 385 OP1 DC B 113 1.655 -9.413 -7.866 1.00 0.00 O ATOM 386 OP2 DC B 113 1.919 -9.330 -10.410 1.00 0.00 O ATOM 387 O5' DC B 113 -0.167 -8.467 -9.312 1.00 0.00 O ATOM 388 C5' DC B 113 -0.881 -7.774 -8.277 1.00 0.00 C ATOM 389 C4' DC B 113 -2.382 -7.611 -8.574 1.00 0.00 C ATOM 390 O4' DC B 113 -2.615 -6.649 -9.628 1.00 0.00 O ATOM 391 C3' DC B 113 -3.036 -8.934 -8.983 1.00 0.00 C ATOM 392 O3' DC B 113 -4.116 -9.249 -8.101 1.00 0.00 O ATOM 393 C2' DC B 113 -3.579 -8.704 -10.373 1.00 0.00 C ATOM 394 C1' DC B 113 -3.464 -7.218 -10.654 1.00 0.00 C ATOM 395 N1 DC B 113 -2.885 -6.945 -11.991 1.00 0.00 N ATOM 396 C2 DC B 113 -3.624 -6.190 -12.898 1.00 0.00 C ATOM 397 O2 DC B 113 -4.778 -5.861 -12.627 1.00 0.00 O ATOM 398 N3 DC B 113 -3.038 -5.832 -14.072 1.00 0.00 N ATOM 399 C4 DC B 113 -1.780 -6.197 -14.350 1.00 0.00 C ATOM 400 N4 DC B 113 -1.228 -5.811 -15.501 1.00 0.00 N ATOM 401 C5 DC B 113 -1.019 -6.980 -13.421 1.00 0.00 C ATOM 402 C6 DC B 113 -1.618 -7.334 -12.267 1.00 0.00 C ATOM 0 H5' DC B 113 -0.437 -6.789 -8.137 1.00 0.00 H new ATOM 0 H5'' DC B 113 -0.761 -8.315 -7.338 1.00 0.00 H new ATOM 0 H4' DC B 113 -2.830 -7.259 -7.645 1.00 0.00 H new ATOM 0 H3' DC B 113 -2.324 -9.758 -8.945 1.00 0.00 H new ATOM 0 H2' DC B 113 -3.016 -9.280 -11.107 1.00 0.00 H new ATOM 0 H2'' DC B 113 -4.617 -9.030 -10.440 1.00 0.00 H new ATOM 0 H1' DC B 113 -4.459 -6.773 -10.645 1.00 0.00 H new ATOM 0 H41 DC B 113 -0.270 -6.083 -15.724 1.00 0.00 H new ATOM 0 H42 DC B 113 -1.763 -5.244 -16.158 1.00 0.00 H new ATOM 0 H5 DC B 113 -0.003 -7.275 -13.638 1.00 0.00 H new ATOM 0 H6 DC B 113 -1.079 -7.937 -11.551 1.00 0.00 H new ATOM 414 P DA B 114 -4.965 -10.607 -8.281 1.00 0.00 P ATOM 415 OP1 DA B 114 -5.561 -10.954 -6.970 1.00 0.00 O ATOM 416 OP2 DA B 114 -4.111 -11.593 -8.983 1.00 0.00 O ATOM 417 O5' DA B 114 -6.162 -10.175 -9.279 1.00 0.00 O ATOM 418 C5' DA B 114 -7.086 -9.142 -8.915 1.00 0.00 C ATOM 419 C4' DA B 114 -8.142 -8.889 -10.006 1.00 0.00 C ATOM 420 O4' DA B 114 -7.540 -8.262 -11.172 1.00 0.00 O ATOM 421 C3' DA B 114 -8.809 -10.192 -10.472 1.00 0.00 C ATOM 422 O3' DA B 114 -10.237 -10.056 -10.469 1.00 0.00 O ATOM 423 C2' DA B 114 -8.322 -10.405 -11.885 1.00 0.00 C ATOM 424 C1' DA B 114 -7.767 -9.073 -12.351 1.00 0.00 C ATOM 425 N9 DA B 114 -6.533 -9.246 -13.135 1.00 0.00 N ATOM 426 C8 DA B 114 -5.395 -9.881 -12.778 1.00 0.00 C ATOM 427 N7 DA B 114 -4.426 -9.822 -13.641 1.00 0.00 N ATOM 428 C5 DA B 114 -4.980 -9.076 -14.678 1.00 0.00 C ATOM 429 C6 DA B 114 -4.476 -8.649 -15.911 1.00 0.00 C ATOM 430 N6 DA B 114 -3.231 -8.903 -16.315 1.00 0.00 N ATOM 431 N1 DA B 114 -5.296 -7.933 -16.701 1.00 0.00 N ATOM 432 C2 DA B 114 -6.538 -7.652 -16.300 1.00 0.00 C ATOM 433 N3 DA B 114 -7.111 -8.003 -15.152 1.00 0.00 N ATOM 434 C4 DA B 114 -6.265 -8.722 -14.381 1.00 0.00 C ATOM 0 H5' DA B 114 -6.538 -8.220 -8.722 1.00 0.00 H new ATOM 0 H5'' DA B 114 -7.586 -9.416 -7.986 1.00 0.00 H new ATOM 0 H4' DA B 114 -8.891 -8.235 -9.560 1.00 0.00 H new ATOM 0 H3' DA B 114 -8.561 -11.026 -9.816 1.00 0.00 H new ATOM 0 H2' DA B 114 -7.555 -11.179 -11.919 1.00 0.00 H new ATOM 0 H2'' DA B 114 -9.136 -10.734 -12.531 1.00 0.00 H new ATOM 0 H1' DA B 114 -8.477 -8.581 -13.015 1.00 0.00 H new ATOM 0 H8 DA B 114 -5.298 -10.403 -11.838 1.00 0.00 H new ATOM 0 H61 DA B 114 -2.912 -8.569 -17.224 1.00 0.00 H new ATOM 0 H62 DA B 114 -2.598 -9.431 -15.715 1.00 0.00 H new ATOM 0 H2 DA B 114 -7.145 -7.076 -16.983 1.00 0.00 H new ATOM 446 P DT B 115 -11.190 -11.280 -10.916 1.00 0.00 P ATOM 447 OP1 DT B 115 -12.490 -11.127 -10.227 1.00 0.00 O ATOM 448 OP2 DT B 115 -10.425 -12.539 -10.775 1.00 0.00 O ATOM 449 O5' DT B 115 -11.420 -11.001 -12.492 1.00 0.00 O ATOM 450 C5' DT B 115 -12.040 -9.780 -12.913 1.00 0.00 C ATOM 451 C4' DT B 115 -12.100 -9.629 -14.441 1.00 0.00 C ATOM 452 O4' DT B 115 -10.780 -9.388 -14.979 1.00 0.00 O ATOM 453 C3' DT B 115 -12.677 -10.870 -15.140 1.00 0.00 C ATOM 454 O3' DT B 115 -13.911 -10.557 -15.790 1.00 0.00 O ATOM 455 C2' DT B 115 -11.647 -11.258 -16.182 1.00 0.00 C ATOM 456 C1' DT B 115 -10.572 -10.175 -16.167 1.00 0.00 C ATOM 457 N1 DT B 115 -9.201 -10.763 -16.184 1.00 0.00 N ATOM 458 C2 DT B 115 -8.354 -10.428 -17.232 1.00 0.00 C ATOM 459 O2 DT B 115 -8.707 -9.685 -18.144 1.00 0.00 O ATOM 460 N3 DT B 115 -7.085 -10.973 -17.187 1.00 0.00 N ATOM 461 C4 DT B 115 -6.593 -11.814 -16.204 1.00 0.00 C ATOM 462 O4 DT B 115 -5.442 -12.243 -16.266 1.00 0.00 O ATOM 463 C5 DT B 115 -7.540 -12.111 -15.155 1.00 0.00 C ATOM 464 C7 DT B 115 -7.106 -13.023 -14.002 1.00 0.00 C ATOM 465 C6 DT B 115 -8.789 -11.587 -15.181 1.00 0.00 C ATOM 0 H5' DT B 115 -11.492 -8.937 -12.492 1.00 0.00 H new ATOM 0 H5'' DT B 115 -13.052 -9.735 -12.510 1.00 0.00 H new ATOM 0 H4' DT B 115 -12.760 -8.783 -14.633 1.00 0.00 H new ATOM 0 H3' DT B 115 -12.876 -11.670 -14.427 1.00 0.00 H new ATOM 0 H2' DT B 115 -11.216 -12.233 -15.955 1.00 0.00 H new ATOM 0 H2'' DT B 115 -12.105 -11.334 -17.168 1.00 0.00 H new ATOM 0 H1' DT B 115 -10.650 -9.555 -17.060 1.00 0.00 H new ATOM 0 H3 DT B 115 -6.452 -10.733 -17.950 1.00 0.00 H new ATOM 0 H71 DT B 115 -6.360 -13.733 -14.360 1.00 0.00 H new ATOM 0 H72 DT B 115 -6.677 -12.419 -13.202 1.00 0.00 H new ATOM 0 H73 DT B 115 -7.971 -13.567 -13.623 1.00 0.00 H new ATOM 0 H6 DT B 115 -9.477 -11.829 -14.384 1.00 0.00 H new ATOM 478 P DT B 116 -14.824 -11.716 -16.438 1.00 0.00 P ATOM 479 OP1 DT B 116 -16.223 -11.232 -16.490 1.00 0.00 O ATOM 480 OP2 DT B 116 -14.513 -12.989 -15.752 1.00 0.00 O ATOM 481 O5' DT B 116 -14.271 -11.816 -17.948 1.00 0.00 O ATOM 482 C5' DT B 116 -14.320 -10.689 -18.825 1.00 0.00 C ATOM 483 C4' DT B 116 -13.551 -10.959 -20.123 1.00 0.00 C ATOM 484 O4' DT B 116 -12.128 -11.016 -19.865 1.00 0.00 O ATOM 485 C3' DT B 116 -13.965 -12.288 -20.771 1.00 0.00 C ATOM 486 O3' DT B 116 -14.670 -12.053 -21.992 1.00 0.00 O ATOM 487 C2' DT B 116 -12.675 -13.038 -21.035 1.00 0.00 C ATOM 488 C1' DT B 116 -11.536 -12.145 -20.545 1.00 0.00 C ATOM 489 N1 DT B 116 -10.616 -12.894 -19.641 1.00 0.00 N ATOM 490 C2 DT B 116 -9.276 -12.984 -19.996 1.00 0.00 C ATOM 491 O2 DT B 116 -8.842 -12.488 -21.033 1.00 0.00 O ATOM 492 N3 DT B 116 -8.456 -13.663 -19.117 1.00 0.00 N ATOM 493 C4 DT B 116 -8.843 -14.256 -17.930 1.00 0.00 C ATOM 494 O4 DT B 116 -8.022 -14.833 -17.222 1.00 0.00 O ATOM 495 C5 DT B 116 -10.252 -14.119 -17.637 1.00 0.00 C ATOM 496 C7 DT B 116 -10.804 -14.756 -16.355 1.00 0.00 C ATOM 497 C6 DT B 116 -11.079 -13.454 -18.483 1.00 0.00 C ATOM 0 H5' DT B 116 -13.898 -9.818 -18.324 1.00 0.00 H new ATOM 0 H5'' DT B 116 -15.358 -10.451 -19.058 1.00 0.00 H new ATOM 0 H4' DT B 116 -13.789 -10.140 -20.801 1.00 0.00 H new ATOM 0 H3' DT B 116 -14.633 -12.858 -20.125 1.00 0.00 H new ATOM 0 H2' DT B 116 -12.670 -13.994 -20.511 1.00 0.00 H new ATOM 0 H2'' DT B 116 -12.565 -13.256 -22.097 1.00 0.00 H new ATOM 0 HO3' DT B 116 -14.925 -12.910 -22.393 1.00 0.00 H new ATOM 0 H1' DT B 116 -10.935 -11.805 -21.389 1.00 0.00 H 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DG C 120 -10.579 -1.909 -20.797 1.00 0.00 H new ATOM 0 H3' DG C 120 -9.380 0.639 -20.555 1.00 0.00 H new ATOM 0 H2' DG C 120 -7.637 0.178 -19.072 1.00 0.00 H new ATOM 0 H2'' DG C 120 -8.904 -0.043 -17.881 1.00 0.00 H new ATOM 0 H1' DG C 120 -8.711 -2.349 -17.927 1.00 0.00 H new ATOM 0 H8 DG C 120 -5.838 -0.914 -20.078 1.00 0.00 H new ATOM 0 H1 DG C 120 -4.143 -4.967 -15.420 1.00 0.00 H new ATOM 0 H21 DG C 120 -7.560 -5.243 -14.841 1.00 0.00 H new ATOM 0 H22 DG C 120 -5.922 -5.727 -14.389 1.00 0.00 H new ATOM 639 P DT C 121 -11.170 1.241 -18.392 1.00 0.00 P ATOM 640 OP1 DT C 121 -12.633 1.459 -18.382 1.00 0.00 O ATOM 641 OP2 DT C 121 -10.258 2.336 -18.796 1.00 0.00 O ATOM 642 O5' DT C 121 -10.725 0.725 -16.933 1.00 0.00 O ATOM 643 C5' DT C 121 -11.365 -0.416 -16.361 1.00 0.00 C ATOM 644 C4' DT C 121 -10.659 -0.903 -15.089 1.00 0.00 C ATOM 645 O4' DT C 121 -9.378 -1.510 -15.391 1.00 0.00 O ATOM 646 C3' DT C 121 -10.409 0.239 -14.094 1.00 0.00 C ATOM 647 O3' DT C 121 -11.253 0.081 -12.950 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-13.614 1.00 0.00 H new ATOM 0 H3 DT C 121 -4.063 -2.281 -14.500 1.00 0.00 H new ATOM 0 H71 DT C 121 -6.097 1.206 -18.058 1.00 0.00 H new ATOM 0 H72 DT C 121 -4.925 2.019 -16.994 1.00 0.00 H new ATOM 0 H73 DT C 121 -4.388 0.710 -18.073 1.00 0.00 H new ATOM 0 H6 DT C 121 -7.534 0.537 -16.251 1.00 0.00 H new ATOM 671 P DT C 122 -11.245 1.144 -11.740 1.00 0.00 P ATOM 672 OP1 DT C 122 -12.554 1.064 -11.053 1.00 0.00 O ATOM 673 OP2 DT C 122 -10.775 2.441 -12.273 1.00 0.00 O ATOM 674 O5' DT C 122 -10.120 0.577 -10.732 1.00 0.00 O ATOM 675 C5' DT C 122 -10.266 -0.724 -10.158 1.00 0.00 C ATOM 676 C4' DT C 122 -9.101 -1.090 -9.228 1.00 0.00 C ATOM 677 O4' DT C 122 -7.877 -1.271 -9.985 1.00 0.00 O ATOM 678 C3' DT C 122 -8.845 -0.002 -8.171 1.00 0.00 C ATOM 679 O3' DT C 122 -9.050 -0.528 -6.858 1.00 0.00 O ATOM 680 C2' DT C 122 -7.403 0.409 -8.342 1.00 0.00 C ATOM 681 C1' DT C 122 -6.798 -0.522 -9.381 1.00 0.00 C ATOM 682 N1 DT C 122 -6.030 0.244 -10.409 1.00 0.00 N ATOM 683 C2 DT C 122 -4.675 -0.028 -10.555 1.00 0.00 C ATOM 684 O2 DT C 122 -4.094 -0.845 -9.842 1.00 0.00 O ATOM 685 N3 DT C 122 -4.012 0.676 -11.543 1.00 0.00 N ATOM 686 C4 DT C 122 -4.569 1.614 -12.390 1.00 0.00 C ATOM 687 O4 DT C 122 -3.882 2.181 -13.237 1.00 0.00 O ATOM 688 C5 DT C 122 -5.981 1.840 -12.176 1.00 0.00 C ATOM 689 C7 DT C 122 -6.710 2.845 -13.075 1.00 0.00 C ATOM 690 C6 DT C 122 -6.656 1.166 -11.211 1.00 0.00 C ATOM 0 H5' DT C 122 -10.336 -1.464 -10.956 1.00 0.00 H new ATOM 0 H5'' DT C 122 -11.201 -0.768 -9.599 1.00 0.00 H new ATOM 0 H4' DT C 122 -9.385 -2.017 -8.730 1.00 0.00 H new ATOM 0 H3' DT C 122 -9.524 0.842 -8.295 1.00 0.00 H new ATOM 0 H2' DT C 122 -7.333 1.447 -8.667 1.00 0.00 H new ATOM 0 H2'' DT C 122 -6.865 0.334 -7.397 1.00 0.00 H new ATOM 0 H1' DT C 122 -6.091 -1.203 -8.907 1.00 0.00 H new ATOM 0 H3 DT C 122 -3.017 0.484 -11.657 1.00 0.00 H new ATOM 0 H71 DT C 122 -7.753 2.546 -13.184 1.00 0.00 H new ATOM 0 H72 DT C 122 -6.662 3.837 -12.626 1.00 0.00 H new ATOM 0 H73 DT C 122 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1.00 0.00 O ATOM 720 C5 DT C 123 -4.789 2.981 -7.868 1.00 0.00 C ATOM 721 C7 DT C 123 -6.050 3.764 -8.251 1.00 0.00 C ATOM 722 C6 DT C 123 -4.817 2.093 -6.840 1.00 0.00 C ATOM 0 H5' DT C 123 -7.026 -1.804 -5.724 1.00 0.00 H new ATOM 0 H5'' DT C 123 -7.399 -1.556 -4.030 1.00 0.00 H new ATOM 0 H4' DT C 123 -5.122 -2.183 -4.226 1.00 0.00 H new ATOM 0 H3' DT C 123 -5.857 0.201 -2.891 1.00 0.00 H new ATOM 0 H2' DT C 123 -4.872 1.791 -4.235 1.00 0.00 H new ATOM 0 H2'' DT C 123 -3.403 1.259 -3.441 1.00 0.00 H new ATOM 0 H1' DT C 123 -2.686 0.049 -5.270 1.00 0.00 H new ATOM 0 H3 DT C 123 -1.629 2.566 -8.725 1.00 0.00 H new ATOM 0 H71 DT C 123 -5.766 4.727 -8.674 1.00 0.00 H new ATOM 0 H72 DT C 123 -6.620 3.198 -8.988 1.00 0.00 H new ATOM 0 H73 DT C 123 -6.662 3.924 -7.364 1.00 0.00 H new ATOM 0 H6 DT C 123 -5.734 1.951 -6.288 1.00 0.00 H new ATOM 735 P DA C 124 -3.570 -0.196 -1.135 1.00 0.00 P ATOM 736 OP1 DA C 124 -3.652 -1.181 -0.033 1.00 0.00 O ATOM 737 OP2 DA C 124 -4.200 1.133 -0.984 1.00 0.00 O ATOM 738 O5' DA C 124 -2.002 0.026 -1.499 1.00 0.00 O ATOM 739 C5' DA C 124 -1.208 -1.128 -1.816 1.00 0.00 C ATOM 740 C4' DA C 124 0.289 -0.841 -2.050 1.00 0.00 C ATOM 741 O4' DA C 124 0.460 -0.092 -3.278 1.00 0.00 O ATOM 742 C3' DA C 124 0.914 -0.010 -0.925 1.00 0.00 C ATOM 743 O3' DA C 124 2.208 -0.518 -0.577 1.00 0.00 O ATOM 744 C2' DA C 124 1.058 1.377 -1.480 1.00 0.00 C ATOM 745 C1' DA C 124 0.920 1.251 -2.989 1.00 0.00 C ATOM 746 N9 DA C 124 -0.010 2.249 -3.524 1.00 0.00 N ATOM 747 C8 DA C 124 -1.254 2.544 -3.099 1.00 0.00 C ATOM 748 N7 DA C 124 -1.861 3.481 -3.757 1.00 0.00 N ATOM 749 C5 DA C 124 -0.921 3.842 -4.714 1.00 0.00 C ATOM 750 C6 DA C 124 -0.935 4.788 -5.737 1.00 0.00 C ATOM 751 N6 DA C 124 -1.974 5.590 -5.961 1.00 0.00 N ATOM 752 N1 DA C 124 0.166 4.885 -6.503 1.00 0.00 N ATOM 753 C2 DA C 124 1.219 4.095 -6.271 1.00 0.00 C ATOM 754 N3 DA C 124 1.331 3.168 -5.329 1.00 0.00 N ATOM 755 C4 DA C 124 0.213 3.096 -4.581 1.00 0.00 C ATOM 0 H5' DA C 124 -1.617 -1.598 -2.710 1.00 0.00 H new ATOM 0 H5'' DA C 124 -1.302 -1.850 -1.005 1.00 0.00 H new ATOM 0 H4' DA C 124 0.783 -1.812 -2.093 1.00 0.00 H new ATOM 0 H3' DA C 124 0.298 -0.038 -0.027 1.00 0.00 H new ATOM 0 H2' DA C 124 0.293 2.039 -1.074 1.00 0.00 H new ATOM 0 H2'' DA C 124 2.025 1.804 -1.213 1.00 0.00 H new ATOM 0 H1' DA C 124 1.883 1.433 -3.467 1.00 0.00 H new ATOM 0 H8 DA C 124 -1.714 2.034 -2.266 1.00 0.00 H new ATOM 0 H61 DA C 124 -1.940 6.268 -6.722 1.00 0.00 H new ATOM 0 H62 DA C 124 -2.804 5.526 -5.372 1.00 0.00 H new ATOM 0 H2 DA C 124 2.071 4.226 -6.921 1.00 0.00 H new ATOM 767 P DT C 125 3.079 0.185 0.587 1.00 0.00 P ATOM 768 OP1 DT C 125 3.997 -0.826 1.155 1.00 0.00 O ATOM 769 OP2 DT C 125 2.150 0.920 1.476 1.00 0.00 O ATOM 770 O5' DT C 125 3.960 1.272 -0.232 1.00 0.00 O ATOM 771 C5' DT C 125 4.874 0.825 -1.244 1.00 0.00 C ATOM 772 C4' DT C 125 5.536 1.971 -2.035 1.00 0.00 C ATOM 773 O4' DT C 125 4.573 2.621 -2.906 1.00 0.00 O ATOM 774 C3' DT C 125 6.145 3.058 -1.133 1.00 0.00 C ATOM 775 O3' DT C 125 7.535 3.246 -1.451 1.00 0.00 O ATOM 776 C2' DT C 125 5.377 4.316 -1.447 1.00 0.00 C ATOM 777 C1' DT C 125 4.703 4.055 -2.783 1.00 0.00 C ATOM 778 N1 DT C 125 3.386 4.746 -2.936 1.00 0.00 N ATOM 779 C2 DT C 125 3.187 5.516 -4.079 1.00 0.00 C ATOM 780 O2 DT C 125 4.078 5.695 -4.908 1.00 0.00 O ATOM 781 N3 DT C 125 1.936 6.077 -4.229 1.00 0.00 N ATOM 782 C4 DT C 125 0.874 5.943 -3.357 1.00 0.00 C ATOM 783 O4 DT C 125 -0.223 6.422 -3.625 1.00 0.00 O ATOM 784 C5 DT C 125 1.164 5.146 -2.194 1.00 0.00 C ATOM 785 C7 DT C 125 0.075 4.970 -1.136 1.00 0.00 C ATOM 786 C6 DT C 125 2.380 4.581 -2.020 1.00 0.00 C ATOM 0 H5' DT C 125 4.342 0.176 -1.940 1.00 0.00 H new ATOM 0 H5'' DT C 125 5.652 0.222 -0.777 1.00 0.00 H new ATOM 0 H4' DT C 125 6.335 1.500 -2.608 1.00 0.00 H new ATOM 0 H3' DT C 125 6.082 2.789 -0.079 1.00 0.00 H new ATOM 0 H2' DT C 125 4.642 4.531 -0.672 1.00 0.00 H new ATOM 0 H2'' DT C 125 6.042 5.178 -1.504 1.00 0.00 H new ATOM 0 H1' DT C 125 5.314 4.470 -3.585 1.00 0.00 H new ATOM 0 H3 DT C 125 1.781 6.644 -5.062 1.00 0.00 H new ATOM 0 H71 DT C 125 0.197 4.004 -0.646 1.00 0.00 H new ATOM 0 H72 DT C 125 0.156 5.765 -0.395 1.00 0.00 H new ATOM 0 H73 DT C 125 -0.905 5.015 -1.611 1.00 0.00 H new ATOM 0 H6 DT C 125 2.563 3.985 -1.138 1.00 0.00 H new ATOM 799 P DC C 126 8.436 4.328 -0.663 1.00 0.00 P ATOM 800 OP1 DC C 126 9.809 3.788 -0.543 1.00 0.00 O ATOM 801 OP2 DC C 126 7.700 4.739 0.555 1.00 0.00 O ATOM 802 O5' DC C 126 8.480 5.594 -1.674 1.00 0.00 O ATOM 803 C5' DC C 126 9.046 5.437 -2.985 1.00 0.00 C ATOM 804 C4' DC C 126 9.017 6.727 -3.829 1.00 0.00 C ATOM 805 O4' DC C 126 7.667 7.043 -4.245 1.00 0.00 O ATOM 806 C3' DC C 126 9.584 7.930 -3.060 1.00 0.00 C ATOM 807 O3' DC C 126 10.759 8.427 -3.703 1.00 0.00 O ATOM 808 C2' DC C 126 8.496 8.985 -3.100 1.00 0.00 C ATOM 809 C1' DC C 126 7.320 8.396 -3.880 1.00 0.00 C ATOM 810 N1 DC C 126 6.091 8.398 -3.046 1.00 0.00 N ATOM 811 C2 DC C 126 4.968 9.090 -3.498 1.00 0.00 C ATOM 812 O2 DC C 126 5.003 9.699 -4.566 1.00 0.00 O ATOM 813 N3 DC C 126 3.848 9.069 -2.726 1.00 0.00 N ATOM 814 C4 DC C 126 3.824 8.401 -1.566 1.00 0.00 C ATOM 815 N4 DC C 126 2.715 8.407 -0.832 1.00 0.00 N ATOM 816 C5 DC C 126 4.971 7.691 -1.102 1.00 0.00 C ATOM 817 C6 DC C 126 6.074 7.718 -1.870 1.00 0.00 C ATOM 0 H5' DC C 126 8.503 4.654 -3.515 1.00 0.00 H new ATOM 0 H5'' DC C 126 10.078 5.099 -2.888 1.00 0.00 H new ATOM 0 H4' DC C 126 9.642 6.538 -4.702 1.00 0.00 H new ATOM 0 H3' DC C 126 9.860 7.658 -2.041 1.00 0.00 H new ATOM 0 H2' DC C 126 8.189 9.259 -2.091 1.00 0.00 H new ATOM 0 H2'' DC C 126 8.859 9.894 -3.580 1.00 0.00 H new ATOM 0 H1' DC C 126 7.122 8.994 -4.769 1.00 0.00 H new ATOM 0 H41 DC C 126 2.687 7.901 0.053 1.00 0.00 H new ATOM 0 H42 DC C 126 1.893 8.917 -1.154 1.00 0.00 H new ATOM 0 H5 DC C 126 4.954 7.151 -0.167 1.00 0.00 H new ATOM 0 H6 DC C 126 6.960 7.191 -1.547 1.00 0.00 H new ATOM 829 P DT C 127 11.685 9.527 -2.979 1.00 0.00 P ATOM 830 OP1 DT C 127 13.020 9.497 -3.624 1.00 0.00 O ATOM 831 OP2 DT C 127 11.570 9.344 -1.517 1.00 0.00 O ATOM 832 O5' DT C 127 10.976 10.915 -3.369 1.00 0.00 O ATOM 833 C5' DT C 127 10.838 11.290 -4.735 1.00 0.00 C ATOM 834 C4' DT C 127 9.942 12.514 -4.892 1.00 0.00 C ATOM 835 O4' DT C 127 8.567 12.181 -4.599 1.00 0.00 O ATOM 836 C3' DT C 127 10.367 13.647 -3.951 1.00 0.00 C ATOM 837 O3' DT C 127 10.880 14.744 -4.707 1.00 0.00 O ATOM 838 C2' DT C 127 9.107 14.055 -3.214 1.00 0.00 C ATOM 839 C1' DT C 127 7.969 13.215 -3.790 1.00 0.00 C ATOM 840 N1 DT C 127 7.118 12.631 -2.710 1.00 0.00 N ATOM 841 C2 DT C 127 5.767 12.956 -2.703 1.00 0.00 C ATOM 842 O2 DT C 127 5.276 13.712 -3.538 1.00 0.00 O ATOM 843 N3 DT C 127 5.005 12.385 -1.703 1.00 0.00 N ATOM 844 C4 DT C 127 5.458 11.528 -0.720 1.00 0.00 C ATOM 845 O4 DT C 127 4.683 11.073 0.119 1.00 0.00 O ATOM 846 C5 DT C 127 6.872 11.241 -0.793 1.00 0.00 C ATOM 847 C7 DT C 127 7.489 10.301 0.248 1.00 0.00 C ATOM 848 C6 DT C 127 7.647 11.788 -1.764 1.00 0.00 C ATOM 0 H5' DT C 127 10.421 10.457 -5.301 1.00 0.00 H new ATOM 0 H5'' DT C 127 11.821 11.501 -5.156 1.00 0.00 H new ATOM 0 H4' DT C 127 10.040 12.845 -5.926 1.00 0.00 H new ATOM 0 H3' DT C 127 11.152 13.334 -3.262 1.00 0.00 H new ATOM 0 H2' DT C 127 9.212 13.882 -2.143 1.00 0.00 H new ATOM 0 H2'' DT C 127 8.908 15.118 -3.347 1.00 0.00 H new ATOM 0 H1' DT C 127 7.309 13.839 -4.393 1.00 0.00 H new ATOM 0 H3 DT C 127 4.012 12.619 -1.689 1.00 0.00 H new ATOM 0 H71 DT C 127 6.936 10.381 1.184 1.00 0.00 H new ATOM 0 H72 DT C 127 7.441 9.274 -0.115 1.00 0.00 H new ATOM 0 H73 DT C 127 8.530 10.578 0.417 1.00 0.00 H new ATOM 0 H6 DT C 127 8.701 11.555 -1.793 1.00 0.00 H new ATOM 861 P DG C 128 11.426 16.072 -3.983 1.00 0.00 P ATOM 862 OP1 DG C 128 12.387 16.737 -4.891 1.00 0.00 O ATOM 863 OP2 DG C 128 11.834 15.715 -2.606 1.00 0.00 O ATOM 864 O5' DG C 128 10.103 16.977 -3.896 1.00 0.00 O ATOM 865 C5' DG C 128 9.419 17.361 -5.086 1.00 0.00 C ATOM 866 C4' DG C 128 8.181 18.194 -4.770 1.00 0.00 C ATOM 867 O4' DG C 128 7.221 17.394 -4.045 1.00 0.00 O ATOM 868 C3' DG C 128 8.516 19.424 -3.918 1.00 0.00 C ATOM 869 O3' DG C 128 8.086 20.601 -4.596 1.00 0.00 O ATOM 870 C2' DG C 128 7.750 19.252 -2.627 1.00 0.00 C ATOM 871 C1' DG C 128 6.861 18.029 -2.802 1.00 0.00 C ATOM 872 N9 DG C 128 7.019 17.102 -1.673 1.00 0.00 N ATOM 873 C8 DG C 128 8.142 16.484 -1.234 1.00 0.00 C ATOM 874 N7 DG C 128 7.979 15.694 -0.215 1.00 0.00 N ATOM 875 C5 DG C 128 6.616 15.802 0.052 1.00 0.00 C ATOM 876 C6 DG C 128 5.828 15.178 1.054 1.00 0.00 C ATOM 877 O6 DG C 128 6.187 14.384 1.922 1.00 0.00 O ATOM 878 N1 DG C 128 4.498 15.567 0.971 1.00 0.00 N ATOM 879 C2 DG C 128 3.985 16.448 0.042 1.00 0.00 C ATOM 880 N2 DG C 128 2.683 16.717 0.132 1.00 0.00 N ATOM 881 N3 DG C 128 4.723 17.034 -0.903 1.00 0.00 N ATOM 882 C4 DG C 128 6.022 16.667 -0.837 1.00 0.00 C ATOM 0 H5' DG C 128 9.128 16.471 -5.644 1.00 0.00 H new ATOM 0 H5'' DG C 128 10.091 17.933 -5.726 1.00 0.00 H new ATOM 0 H4' DG C 128 7.771 18.528 -5.723 1.00 0.00 H new ATOM 0 H3' DG C 128 9.586 19.518 -3.733 1.00 0.00 H new ATOM 0 H2' DG C 128 8.432 19.117 -1.788 1.00 0.00 H new ATOM 0 H2'' DG C 128 7.152 20.137 -2.412 1.00 0.00 H new ATOM 0 H1' DG C 128 5.813 18.327 -2.825 1.00 0.00 H new ATOM 0 H8 DG C 128 9.105 16.637 -1.698 1.00 0.00 H new ATOM 0 H1 DG C 128 3.849 15.170 1.651 1.00 0.00 H new ATOM 0 H21 DG C 128 2.249 17.362 -0.528 1.00 0.00 H new ATOM 0 H22 DG C 128 2.121 16.278 0.861 1.00 0.00 H new ATOM 894 P DC C 129 8.493 22.071 -4.087 1.00 0.00 P ATOM 895 OP1 DC C 129 8.426 22.992 -5.243 1.00 0.00 O ATOM 896 OP2 DC C 129 9.746 21.960 -3.306 1.00 0.00 O ATOM 897 O5' DC C 129 7.299 22.450 -3.074 1.00 0.00 O ATOM 898 C5' DC C 129 5.950 22.506 -3.542 1.00 0.00 C ATOM 899 C4' DC C 129 4.968 22.883 -2.426 1.00 0.00 C ATOM 900 O4' DC C 129 4.842 21.811 -1.462 1.00 0.00 O ATOM 901 C3' DC C 129 5.423 24.140 -1.677 1.00 0.00 C ATOM 902 O3' DC C 129 4.433 25.165 -1.789 1.00 0.00 O ATOM 903 C2' DC C 129 5.585 23.728 -0.235 1.00 0.00 C ATOM 904 C1' DC C 129 5.110 22.290 -0.122 1.00 0.00 C ATOM 905 N1 DC C 129 6.128 21.426 0.539 1.00 0.00 N ATOM 906 C2 DC C 129 5.768 20.769 1.714 1.00 0.00 C ATOM 907 O2 DC C 129 4.658 20.960 2.210 1.00 0.00 O ATOM 908 N3 DC C 129 6.665 19.923 2.288 1.00 0.00 N ATOM 909 C4 DC C 129 7.871 19.724 1.740 1.00 0.00 C ATOM 910 N4 DC C 129 8.717 18.869 2.315 1.00 0.00 N ATOM 911 C5 DC C 129 8.254 20.401 0.539 1.00 0.00 C ATOM 912 C6 DC C 129 7.360 21.239 -0.025 1.00 0.00 C ATOM 0 H5' DC C 129 5.671 21.538 -3.959 1.00 0.00 H new ATOM 0 H5'' DC C 129 5.877 23.234 -4.350 1.00 0.00 H new ATOM 0 H4' DC C 129 4.009 23.071 -2.908 1.00 0.00 H new ATOM 0 H3' DC C 129 6.352 24.536 -2.087 1.00 0.00 H new ATOM 0 H2' DC C 129 6.626 23.815 0.075 1.00 0.00 H new ATOM 0 H2'' DC C 129 5.003 24.378 0.418 1.00 0.00 H new ATOM 0 H1' DC C 129 4.212 22.250 0.494 1.00 0.00 H new ATOM 0 H41 DC C 129 9.638 18.710 1.906 1.00 0.00 H new ATOM 0 H42 DC C 129 8.443 18.374 3.164 1.00 0.00 H new ATOM 0 H5 DC C 129 9.228 20.246 0.098 1.00 0.00 H new ATOM 0 H6 DC C 129 7.619 21.767 -0.931 1.00 0.00 H new ATOM 924 P DA C 130 4.679 26.629 -1.160 1.00 0.00 P ATOM 925 OP1 DA C 130 3.842 27.590 -1.911 1.00 0.00 O ATOM 926 OP2 DA C 130 6.140 26.845 -1.070 1.00 0.00 O ATOM 927 O5' DA C 130 4.096 26.527 0.343 1.00 0.00 O ATOM 928 C5' DA C 130 2.713 26.224 0.569 1.00 0.00 C ATOM 929 C4' DA C 130 2.362 26.174 2.066 1.00 0.00 C ATOM 930 O4' DA C 130 2.951 25.011 2.699 1.00 0.00 O ATOM 931 C3' DA C 130 2.868 27.422 2.805 1.00 0.00 C ATOM 932 O3' DA C 130 1.822 28.007 3.590 1.00 0.00 O ATOM 933 C2' DA C 130 3.961 26.926 3.716 1.00 0.00 C ATOM 934 C1' DA C 130 3.797 25.418 3.797 1.00 0.00 C ATOM 935 N9 DA C 130 5.094 24.730 3.753 1.00 0.00 N ATOM 936 C8 DA C 130 6.069 24.826 2.823 1.00 0.00 C ATOM 937 N7 DA C 130 7.109 24.076 3.025 1.00 0.00 N ATOM 938 C5 DA C 130 6.789 23.418 4.209 1.00 0.00 C ATOM 939 C6 DA C 130 7.469 22.473 4.979 1.00 0.00 C ATOM 940 N6 DA C 130 8.677 22.016 4.660 1.00 0.00 N ATOM 941 N1 DA C 130 6.864 22.030 6.094 1.00 0.00 N ATOM 942 C2 DA C 130 5.659 22.492 6.432 1.00 0.00 C ATOM 943 N3 DA C 130 4.930 23.386 5.773 1.00 0.00 N ATOM 944 C4 DA C 130 5.564 23.810 4.661 1.00 0.00 C ATOM 0 H5' DA C 130 2.474 25.265 0.110 1.00 0.00 H new ATOM 0 H5'' DA C 130 2.094 26.975 0.078 1.00 0.00 H new ATOM 0 H4' DA C 130 1.275 26.126 2.128 1.00 0.00 H new ATOM 0 H3' DA C 130 3.215 28.184 2.107 1.00 0.00 H new ATOM 0 H2' DA C 130 4.943 27.190 3.324 1.00 0.00 H new ATOM 0 H2'' DA C 130 3.880 27.380 4.704 1.00 0.00 H new ATOM 0 H1' DA C 130 3.340 25.144 4.748 1.00 0.00 H new ATOM 0 H8 DA C 130 5.989 25.482 1.969 1.00 0.00 H new ATOM 0 H61 DA C 130 9.134 21.325 5.255 1.00 0.00 H new ATOM 0 H62 DA C 130 9.146 22.357 3.821 1.00 0.00 H new ATOM 0 H2 DA C 130 5.229 22.096 7.340 1.00 0.00 H new ATOM 956 P DA C 131 2.091 29.335 4.468 1.00 0.00 P ATOM 957 OP1 DA C 131 0.797 30.025 4.667 1.00 0.00 O ATOM 958 OP2 DA C 131 3.228 30.063 3.863 1.00 0.00 O ATOM 959 O5' DA C 131 2.572 28.752 5.897 1.00 0.00 O ATOM 960 C5' DA C 131 1.658 28.033 6.731 1.00 0.00 C ATOM 961 C4' DA C 131 2.305 27.561 8.045 1.00 0.00 C ATOM 962 O4' DA C 131 3.256 26.494 7.809 1.00 0.00 O ATOM 963 C3' DA C 131 3.043 28.700 8.761 1.00 0.00 C ATOM 964 O3' DA C 131 2.455 28.969 10.036 1.00 0.00 O ATOM 965 C2' DA C 131 4.456 28.208 8.964 1.00 0.00 C ATOM 966 C1' DA C 131 4.491 26.758 8.514 1.00 0.00 C ATOM 967 N9 DA C 131 5.657 26.490 7.658 1.00 0.00 N ATOM 968 C8 DA C 131 6.010 27.098 6.504 1.00 0.00 C ATOM 969 N7 DA C 131 7.089 26.643 5.941 1.00 0.00 N ATOM 970 C5 DA C 131 7.494 25.635 6.814 1.00 0.00 C ATOM 971 C6 DA C 131 8.578 24.750 6.807 1.00 0.00 C ATOM 972 N6 DA C 131 9.498 24.734 5.843 1.00 0.00 N ATOM 973 N1 DA C 131 8.677 23.883 7.830 1.00 0.00 N ATOM 974 C2 DA C 131 7.763 23.886 8.802 1.00 0.00 C ATOM 975 N3 DA C 131 6.700 24.679 8.903 1.00 0.00 N ATOM 976 C4 DA C 131 6.628 25.537 7.865 1.00 0.00 C ATOM 0 H5' DA C 131 1.277 27.169 6.187 1.00 0.00 H new ATOM 0 H5'' DA C 131 0.802 28.669 6.959 1.00 0.00 H new ATOM 0 H4' DA C 131 1.488 27.205 8.672 1.00 0.00 H new ATOM 0 H3' DA C 131 2.998 29.619 8.177 1.00 0.00 H new ATOM 0 H2' DA C 131 5.160 28.808 8.387 1.00 0.00 H new ATOM 0 H2'' DA C 131 4.748 28.294 10.011 1.00 0.00 H new ATOM 0 H1' DA C 131 4.585 26.099 9.377 1.00 0.00 H new ATOM 0 H8 DA C 131 5.435 27.907 6.079 1.00 0.00 H new ATOM 0 H61 DA C 131 10.269 24.068 5.885 1.00 0.00 H new ATOM 0 H62 DA C 131 9.431 25.388 5.063 1.00 0.00 H new ATOM 0 H2 DA C 131 7.902 23.165 9.594 1.00 0.00 H new ATOM 988 P DC C 132 3.035 30.152 10.966 1.00 0.00 P ATOM 989 OP1 DC C 132 1.954 30.595 11.874 1.00 0.00 O ATOM 990 OP2 DC C 132 3.711 31.137 10.091 1.00 0.00 O ATOM 991 O5' DC C 132 4.161 29.408 11.850 1.00 0.00 O ATOM 992 C5' DC C 132 3.828 28.245 12.613 1.00 0.00 C ATOM 993 C4' DC C 132 5.067 27.568 13.218 1.00 0.00 C ATOM 994 O4' DC C 132 5.866 26.929 12.195 1.00 0.00 O ATOM 995 C3' DC C 132 5.970 28.561 13.962 1.00 0.00 C ATOM 996 O3' DC C 132 5.920 28.333 15.371 1.00 0.00 O ATOM 997 C2' DC C 132 7.371 28.300 13.440 1.00 0.00 C ATOM 998 C1' DC C 132 7.268 27.139 12.466 1.00 0.00 C ATOM 999 N1 DC C 132 8.031 27.422 11.220 1.00 0.00 N ATOM 1000 C2 DC C 132 9.168 26.663 10.948 1.00 0.00 C ATOM 1001 O2 DC C 132 9.496 25.755 11.707 1.00 0.00 O ATOM 1002 N3 DC C 132 9.889 26.955 9.830 1.00 0.00 N ATOM 1003 C4 DC C 132 9.513 27.942 9.009 1.00 0.00 C ATOM 1004 N4 DC C 132 10.239 28.200 7.921 1.00 0.00 N ATOM 1005 C5 DC C 132 8.344 28.719 9.281 1.00 0.00 C ATOM 1006 C6 DC C 132 7.641 28.423 10.391 1.00 0.00 C ATOM 0 H5' DC C 132 3.303 27.533 11.976 1.00 0.00 H new ATOM 0 H5'' DC C 132 3.142 28.523 13.413 1.00 0.00 H new ATOM 0 H4' DC C 132 4.685 26.829 13.922 1.00 0.00 H new ATOM 0 H3' DC C 132 5.655 29.591 13.796 1.00 0.00 H new ATOM 0 H2' DC C 132 7.770 29.185 12.945 1.00 0.00 H new ATOM 0 H2'' DC C 132 8.050 28.059 14.258 1.00 0.00 H new ATOM 0 HO3' DC C 132 6.503 28.975 15.827 1.00 0.00 H new ATOM 0 H1' DC C 132 7.704 26.236 12.894 1.00 0.00 H new ATOM 0 H41 DC C 132 9.961 28.950 7.288 1.00 0.00 H new ATOM 0 H42 DC C 132 11.072 27.647 7.721 1.00 0.00 H new ATOM 0 H5 DC C 132 8.036 29.515 8.620 1.00 0.00 H new ATOM 0 H6 DC C 132 6.753 28.991 10.625 1.00 0.00 H new TER 1019 DC C 132 ATOM 1020 N LYS A 1 -5.429 14.418 14.044 1.00 0.00 N ATOM 1021 CA LYS A 1 -6.737 14.194 13.365 1.00 0.00 C ATOM 1022 C LYS A 1 -6.846 12.721 12.937 1.00 0.00 C ATOM 1023 O LYS A 1 -7.926 12.213 12.711 1.00 0.00 O ATOM 1024 CB LYS A 1 -6.826 15.115 12.142 1.00 0.00 C ATOM 1025 CG LYS A 1 -6.973 16.570 12.611 1.00 0.00 C ATOM 1026 CD LYS A 1 -7.022 17.502 11.395 1.00 0.00 C ATOM 1027 CE LYS A 1 -7.169 18.961 11.850 1.00 0.00 C ATOM 1028 NZ LYS A 1 -6.271 19.230 13.010 1.00 0.00 N ATOM 0 H1 LYS A 1 -5.470 15.300 14.594 1.00 0.00 H new ATOM 0 H2 LYS A 1 -5.228 13.621 14.681 1.00 0.00 H new ATOM 0 H3 LYS A 1 -4.675 14.490 13.331 1.00 0.00 H new ATOM 0 HA LYS A 1 -7.558 14.421 14.045 1.00 0.00 H new ATOM 0 HB2 LYS A 1 -5.933 15.008 11.526 1.00 0.00 H new ATOM 0 HB3 LYS A 1 -7.677 14.833 11.522 1.00 0.00 H new ATOM 0 HG2 LYS A 1 -7.881 16.681 13.203 1.00 0.00 H new ATOM 0 HG3 LYS A 1 -6.137 16.841 13.255 1.00 0.00 H new ATOM 0 HD2 LYS A 1 -6.114 17.388 10.803 1.00 0.00 H new ATOM 0 HD3 LYS A 1 -7.858 17.228 10.751 1.00 0.00 H new ATOM 0 HE2 LYS A 1 -6.924 19.633 11.027 1.00 0.00 H new ATOM 0 HE3 LYS A 1 -8.204 19.161 12.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 -6.073 20.249 13.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 -6.734 18.917 13.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 -5.378 18.711 12.886 1.00 0.00 H new ATOM 1044 N ARG A 2 -5.737 12.024 12.842 1.00 0.00 N ATOM 1045 CA ARG A 2 -5.794 10.579 12.451 1.00 0.00 C ATOM 1046 C ARG A 2 -6.515 9.804 13.556 1.00 0.00 C ATOM 1047 O ARG A 2 -7.283 8.904 13.300 1.00 0.00 O ATOM 1048 CB ARG A 2 -4.362 10.026 12.266 1.00 0.00 C ATOM 1049 CG ARG A 2 -3.918 10.178 10.805 1.00 0.00 C ATOM 1050 CD ARG A 2 -3.876 11.656 10.418 1.00 0.00 C ATOM 1051 NE ARG A 2 -3.526 11.775 8.978 1.00 0.00 N ATOM 1052 CZ ARG A 2 -3.757 12.889 8.342 1.00 0.00 C ATOM 1053 NH1 ARG A 2 -4.223 13.926 8.983 1.00 0.00 N ATOM 1054 NH2 ARG A 2 -3.511 12.966 7.065 1.00 0.00 N ATOM 0 H ARG A 2 -4.801 12.391 13.017 1.00 0.00 H new ATOM 0 HA ARG A 2 -6.332 10.469 11.509 1.00 0.00 H new ATOM 0 HB2 ARG A 2 -3.672 10.558 12.920 1.00 0.00 H new ATOM 0 HB3 ARG A 2 -4.330 8.976 12.556 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -2.934 9.730 10.668 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -4.606 9.642 10.151 1.00 0.00 H new ATOM 0 HD2 ARG A 2 -4.843 12.122 10.609 1.00 0.00 H new ATOM 0 HD3 ARG A 2 -3.142 12.183 11.028 1.00 0.00 H new ATOM 0 HE ARG A 2 -3.105 10.985 8.488 1.00 0.00 H new ATOM 0 HH11 ARG A 2 -4.407 13.866 9.984 1.00 0.00 H new ATOM 0 HH12 ARG A 2 -4.403 14.796 8.483 1.00 0.00 H new ATOM 0 HH21 ARG A 2 -3.139 12.157 6.568 1.00 0.00 H new ATOM 0 HH22 ARG A 2 -3.690 13.835 6.563 1.00 0.00 H new ATOM 1068 N ALA A 3 -6.244 10.140 14.782 1.00 0.00 N ATOM 1069 CA ALA A 3 -6.884 9.430 15.926 1.00 0.00 C ATOM 1070 C ALA A 3 -8.398 9.283 15.707 1.00 0.00 C ATOM 1071 O ALA A 3 -9.133 10.251 15.723 1.00 0.00 O ATOM 1072 CB ALA A 3 -6.643 10.241 17.201 1.00 0.00 C ATOM 0 H ALA A 3 -5.599 10.885 15.047 1.00 0.00 H new ATOM 0 HA ALA A 3 -6.448 8.434 16.010 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -7.106 9.734 18.048 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -5.571 10.334 17.376 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -7.080 11.233 17.089 1.00 0.00 H new ATOM 1078 N GLY A 4 -8.874 8.071 15.547 1.00 0.00 N ATOM 1079 CA GLY A 4 -10.348 7.848 15.377 1.00 0.00 C ATOM 1080 C GLY A 4 -10.773 7.953 13.905 1.00 0.00 C ATOM 1081 O GLY A 4 -11.917 7.717 13.569 1.00 0.00 O ATOM 0 H GLY A 4 -8.305 7.224 15.527 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -10.614 6.864 15.763 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -10.897 8.581 15.967 1.00 0.00 H new ATOM 1085 N THR A 5 -9.886 8.330 13.030 1.00 0.00 N ATOM 1086 CA THR A 5 -10.272 8.474 11.594 1.00 0.00 C ATOM 1087 C THR A 5 -10.569 7.110 10.972 1.00 0.00 C ATOM 1088 O THR A 5 -9.707 6.260 10.867 1.00 0.00 O ATOM 1089 CB THR A 5 -9.129 9.118 10.820 1.00 0.00 C ATOM 1090 OG1 THR A 5 -8.681 10.273 11.514 1.00 0.00 O ATOM 1091 CG2 THR A 5 -9.602 9.514 9.414 1.00 0.00 C ATOM 0 H THR A 5 -8.912 8.545 13.243 1.00 0.00 H new ATOM 0 HA THR A 5 -11.166 9.095 11.543 1.00 0.00 H new ATOM 0 HB THR A 5 -8.311 8.404 10.731 1.00 0.00 H new ATOM 0 HG1 THR A 5 -9.114 11.068 11.139 1.00 0.00 H new ATOM 0 HG21 THR A 5 -8.778 9.974 8.869 1.00 0.00 H new ATOM 0 HG22 THR A 5 -9.940 8.626 8.880 1.00 0.00 H new ATOM 0 HG23 THR A 5 -10.425 10.224 9.494 1.00 0.00 H new ATOM 1099 N VAL A 6 -11.782 6.921 10.521 1.00 0.00 N ATOM 1100 CA VAL A 6 -12.175 5.644 9.850 1.00 0.00 C ATOM 1101 C VAL A 6 -12.668 5.994 8.450 1.00 0.00 C ATOM 1102 O VAL A 6 -13.306 7.008 8.250 1.00 0.00 O ATOM 1103 CB VAL A 6 -13.293 4.950 10.623 1.00 0.00 C ATOM 1104 CG1 VAL A 6 -12.752 4.434 11.957 1.00 0.00 C ATOM 1105 CG2 VAL A 6 -14.429 5.942 10.875 1.00 0.00 C ATOM 0 H VAL A 6 -12.531 7.610 10.590 1.00 0.00 H new ATOM 0 HA VAL A 6 -11.322 4.967 9.810 1.00 0.00 H new ATOM 0 HB VAL A 6 -13.670 4.109 10.041 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -13.552 3.939 12.507 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -11.945 3.724 11.773 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -12.372 5.270 12.544 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -15.228 5.447 11.427 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -14.054 6.785 11.456 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -14.816 6.302 9.922 1.00 0.00 H new ATOM 1115 N CYS A 7 -12.383 5.183 7.475 1.00 0.00 N ATOM 1116 CA CYS A 7 -12.841 5.496 6.096 1.00 0.00 C ATOM 1117 C CYS A 7 -14.357 5.595 6.046 1.00 0.00 C ATOM 1118 O CYS A 7 -15.067 4.654 6.339 1.00 0.00 O ATOM 1119 CB CYS A 7 -12.382 4.384 5.169 1.00 0.00 C ATOM 1120 SG CYS A 7 -12.744 4.838 3.459 1.00 0.00 S ATOM 0 H CYS A 7 -11.853 4.317 7.572 1.00 0.00 H new ATOM 0 HA CYS A 7 -12.419 6.452 5.786 1.00 0.00 H new ATOM 0 HB2 CYS A 7 -11.313 4.211 5.292 1.00 0.00 H new ATOM 0 HB3 CYS A 7 -12.887 3.452 5.424 1.00 0.00 H new ATOM 1125 N SER A 8 -14.854 6.736 5.675 1.00 0.00 N ATOM 1126 CA SER A 8 -16.321 6.918 5.597 1.00 0.00 C ATOM 1127 C SER A 8 -16.919 5.943 4.583 1.00 0.00 C ATOM 1128 O SER A 8 -17.985 5.398 4.795 1.00 0.00 O ATOM 1129 CB SER A 8 -16.621 8.344 5.144 1.00 0.00 C ATOM 1130 OG SER A 8 -16.094 9.259 6.096 1.00 0.00 O ATOM 0 H SER A 8 -14.302 7.555 5.421 1.00 0.00 H new ATOM 0 HA SER A 8 -16.757 6.730 6.578 1.00 0.00 H new ATOM 0 HB2 SER A 8 -16.181 8.527 4.164 1.00 0.00 H new ATOM 0 HB3 SER A 8 -17.697 8.487 5.042 1.00 0.00 H new ATOM 0 HG SER A 8 -15.120 9.310 5.996 1.00 0.00 H new ATOM 1136 N ASN A 9 -16.265 5.730 3.466 1.00 0.00 N ATOM 1137 CA ASN A 9 -16.849 4.810 2.452 1.00 0.00 C ATOM 1138 C ASN A 9 -16.653 3.343 2.840 1.00 0.00 C ATOM 1139 O ASN A 9 -17.530 2.539 2.585 1.00 0.00 O ATOM 1140 CB ASN A 9 -16.196 5.066 1.092 1.00 0.00 C ATOM 1141 CG ASN A 9 -16.661 6.421 0.553 1.00 0.00 C ATOM 1142 OD1 ASN A 9 -17.676 6.939 0.976 1.00 0.00 O ATOM 1143 ND2 ASN A 9 -15.961 7.021 -0.370 1.00 0.00 N ATOM 0 H ASN A 9 -15.368 6.147 3.219 1.00 0.00 H new ATOM 0 HA ASN A 9 -17.920 5.006 2.400 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -15.110 5.054 1.189 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -16.462 4.273 0.393 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -16.266 7.923 -0.735 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -15.109 6.588 -0.726 1.00 0.00 H new ATOM 1150 N CYS A 10 -15.520 2.950 3.413 1.00 0.00 N ATOM 1151 CA CYS A 10 -15.337 1.490 3.747 1.00 0.00 C ATOM 1152 C CYS A 10 -14.850 1.257 5.190 1.00 0.00 C ATOM 1153 O CYS A 10 -14.461 0.159 5.532 1.00 0.00 O ATOM 1154 CB CYS A 10 -14.383 0.832 2.735 1.00 0.00 C ATOM 1155 SG CYS A 10 -12.656 1.160 3.165 1.00 0.00 S ATOM 0 H CYS A 10 -14.739 3.560 3.656 1.00 0.00 H new ATOM 0 HA CYS A 10 -16.319 1.022 3.678 1.00 0.00 H new ATOM 0 HB2 CYS A 10 -14.558 -0.244 2.711 1.00 0.00 H new ATOM 0 HB3 CYS A 10 -14.591 1.211 1.734 1.00 0.00 H new ATOM 1160 N GLN A 11 -14.919 2.241 6.051 1.00 0.00 N ATOM 1161 CA GLN A 11 -14.533 2.044 7.492 1.00 0.00 C ATOM 1162 C GLN A 11 -13.099 1.532 7.704 1.00 0.00 C ATOM 1163 O GLN A 11 -12.689 1.344 8.834 1.00 0.00 O ATOM 1164 CB GLN A 11 -15.502 1.048 8.135 1.00 0.00 C ATOM 1165 CG GLN A 11 -16.891 1.676 8.230 1.00 0.00 C ATOM 1166 CD GLN A 11 -17.896 0.610 8.666 1.00 0.00 C ATOM 1167 OE1 GLN A 11 -17.743 -0.552 8.350 1.00 0.00 O ATOM 1168 NE2 GLN A 11 -18.924 0.960 9.390 1.00 0.00 N ATOM 0 H GLN A 11 -15.229 3.185 5.819 1.00 0.00 H new ATOM 0 HA GLN A 11 -14.583 3.030 7.954 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -15.545 0.133 7.544 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -15.148 0.770 9.128 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -16.883 2.499 8.945 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -17.181 2.094 7.266 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -19.052 1.937 9.655 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -19.599 0.257 9.691 1.00 0.00 H new ATOM 1177 N THR A 12 -12.319 1.302 6.689 1.00 0.00 N ATOM 1178 CA THR A 12 -10.937 0.807 6.968 1.00 0.00 C ATOM 1179 C THR A 12 -10.216 1.852 7.834 1.00 0.00 C ATOM 1180 O THR A 12 -10.585 3.008 7.822 1.00 0.00 O ATOM 1181 CB THR A 12 -10.175 0.582 5.646 1.00 0.00 C ATOM 1182 OG1 THR A 12 -8.974 -0.124 5.915 1.00 0.00 O ATOM 1183 CG2 THR A 12 -9.832 1.906 4.948 1.00 0.00 C ATOM 0 H THR A 12 -12.563 1.429 5.707 1.00 0.00 H new ATOM 0 HA THR A 12 -10.979 -0.145 7.497 1.00 0.00 H new ATOM 0 HB THR A 12 -10.821 0.009 4.981 1.00 0.00 H new ATOM 0 HG1 THR A 12 -8.487 -0.271 5.078 1.00 0.00 H new ATOM 0 HG21 THR A 12 -9.296 1.701 4.021 1.00 0.00 H new ATOM 0 HG22 THR A 12 -10.751 2.448 4.723 1.00 0.00 H new ATOM 0 HG23 THR A 12 -9.205 2.511 5.603 1.00 0.00 H new ATOM 1191 N SER A 13 -9.189 1.480 8.572 1.00 0.00 N ATOM 1192 CA SER A 13 -8.451 2.496 9.410 1.00 0.00 C ATOM 1193 C SER A 13 -6.946 2.322 9.178 1.00 0.00 C ATOM 1194 O SER A 13 -6.125 2.900 9.864 1.00 0.00 O ATOM 1195 CB SER A 13 -8.774 2.287 10.890 1.00 0.00 C ATOM 1196 OG SER A 13 -8.432 0.957 11.260 1.00 0.00 O ATOM 0 H SER A 13 -8.831 0.527 8.632 1.00 0.00 H new ATOM 0 HA SER A 13 -8.758 3.502 9.125 1.00 0.00 H new ATOM 0 HB2 SER A 13 -8.220 3.001 11.500 1.00 0.00 H new ATOM 0 HB3 SER A 13 -9.833 2.467 11.072 1.00 0.00 H new ATOM 0 HG SER A 13 -8.636 0.819 12.209 1.00 0.00 H new ATOM 1202 N THR A 14 -6.587 1.518 8.208 1.00 0.00 N ATOM 1203 CA THR A 14 -5.144 1.270 7.892 1.00 0.00 C ATOM 1204 C THR A 14 -4.829 1.829 6.513 1.00 0.00 C ATOM 1205 O THR A 14 -4.347 1.144 5.647 1.00 0.00 O ATOM 1206 CB THR A 14 -4.892 -0.231 7.887 1.00 0.00 C ATOM 1207 OG1 THR A 14 -5.687 -0.841 6.881 1.00 0.00 O ATOM 1208 CG2 THR A 14 -5.265 -0.791 9.252 1.00 0.00 C ATOM 0 H THR A 14 -7.243 1.014 7.611 1.00 0.00 H new ATOM 0 HA THR A 14 -4.513 1.754 8.638 1.00 0.00 H new ATOM 0 HB THR A 14 -3.842 -0.435 7.679 1.00 0.00 H new ATOM 0 HG1 THR A 14 -5.342 -0.594 5.997 1.00 0.00 H new ATOM 0 HG21 THR A 14 -5.090 -1.867 9.264 1.00 0.00 H new ATOM 0 HG22 THR A 14 -4.655 -0.315 10.020 1.00 0.00 H new ATOM 0 HG23 THR A 14 -6.318 -0.593 9.451 1.00 0.00 H new ATOM 1216 N THR A 15 -5.179 3.044 6.285 1.00 0.00 N ATOM 1217 CA THR A 15 -4.969 3.642 4.936 1.00 0.00 C ATOM 1218 C THR A 15 -3.515 4.065 4.741 1.00 0.00 C ATOM 1219 O THR A 15 -2.842 4.459 5.673 1.00 0.00 O ATOM 1220 CB THR A 15 -5.850 4.880 4.822 1.00 0.00 C ATOM 1221 OG1 THR A 15 -5.194 5.982 5.434 1.00 0.00 O ATOM 1222 CG2 THR A 15 -7.154 4.614 5.553 1.00 0.00 C ATOM 0 H THR A 15 -5.606 3.665 6.972 1.00 0.00 H new ATOM 0 HA THR A 15 -5.221 2.900 4.178 1.00 0.00 H new ATOM 0 HB THR A 15 -6.042 5.105 3.773 1.00 0.00 H new ATOM 0 HG1 THR A 15 -5.813 6.433 6.045 1.00 0.00 H new ATOM 0 HG21 THR A 15 -7.797 5.491 5.481 1.00 0.00 H new ATOM 0 HG22 THR A 15 -7.656 3.758 5.102 1.00 0.00 H new ATOM 0 HG23 THR A 15 -6.946 4.401 6.602 1.00 0.00 H new ATOM 1230 N THR A 16 -3.034 4.026 3.524 1.00 0.00 N ATOM 1231 CA THR A 16 -1.640 4.475 3.277 1.00 0.00 C ATOM 1232 C THR A 16 -1.636 6.001 3.361 1.00 0.00 C ATOM 1233 O THR A 16 -0.731 6.606 3.901 1.00 0.00 O ATOM 1234 CB THR A 16 -1.162 4.040 1.888 1.00 0.00 C ATOM 1235 OG1 THR A 16 -1.868 4.766 0.893 1.00 0.00 O ATOM 1236 CG2 THR A 16 -1.394 2.547 1.693 1.00 0.00 C ATOM 0 H THR A 16 -3.544 3.705 2.701 1.00 0.00 H new ATOM 0 HA THR A 16 -0.970 4.032 4.013 1.00 0.00 H new ATOM 0 HB THR A 16 -0.095 4.245 1.802 1.00 0.00 H new ATOM 0 HG1 THR A 16 -2.225 4.144 0.226 1.00 0.00 H new ATOM 0 HG21 THR A 16 -1.050 2.252 0.702 1.00 0.00 H new ATOM 0 HG22 THR A 16 -0.841 1.991 2.450 1.00 0.00 H new ATOM 0 HG23 THR A 16 -2.458 2.329 1.788 1.00 0.00 H new ATOM 1244 N LEU A 17 -2.672 6.627 2.843 1.00 0.00 N ATOM 1245 CA LEU A 17 -2.770 8.121 2.906 1.00 0.00 C ATOM 1246 C LEU A 17 -4.240 8.507 3.114 1.00 0.00 C ATOM 1247 O LEU A 17 -5.119 8.011 2.434 1.00 0.00 O ATOM 1248 CB LEU A 17 -2.239 8.761 1.602 1.00 0.00 C ATOM 1249 CG LEU A 17 -1.614 10.136 1.895 1.00 0.00 C ATOM 1250 CD1 LEU A 17 -0.363 9.984 2.799 1.00 0.00 C ATOM 1251 CD2 LEU A 17 -1.244 10.822 0.559 1.00 0.00 C ATOM 0 H LEU A 17 -3.454 6.164 2.379 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.163 8.487 3.734 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -1.497 8.107 1.145 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -3.053 8.870 0.885 1.00 0.00 H new ATOM 0 HG LEU A 17 -2.336 10.755 2.427 1.00 0.00 H new ATOM 0 HD11 LEU A 17 0.066 10.967 2.995 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -0.650 9.518 3.742 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.376 9.360 2.296 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -0.801 11.797 0.761 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.528 10.203 0.018 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -2.142 10.950 -0.045 1.00 0.00 H new ATOM 1263 N TRP A 18 -4.519 9.384 4.041 1.00 0.00 N ATOM 1264 CA TRP A 18 -5.930 9.793 4.277 1.00 0.00 C ATOM 1265 C TRP A 18 -6.360 10.810 3.219 1.00 0.00 C ATOM 1266 O TRP A 18 -5.709 11.810 2.991 1.00 0.00 O ATOM 1267 CB TRP A 18 -6.039 10.420 5.678 1.00 0.00 C ATOM 1268 CG TRP A 18 -6.159 9.326 6.694 1.00 0.00 C ATOM 1269 CD1 TRP A 18 -5.252 9.039 7.655 1.00 0.00 C ATOM 1270 CD2 TRP A 18 -7.233 8.356 6.843 1.00 0.00 C ATOM 1271 NE1 TRP A 18 -5.706 7.952 8.383 1.00 0.00 N ATOM 1272 CE2 TRP A 18 -6.923 7.500 7.922 1.00 0.00 C ATOM 1273 CE3 TRP A 18 -8.436 8.141 6.151 1.00 0.00 C ATOM 1274 CZ2 TRP A 18 -7.776 6.465 8.304 1.00 0.00 C ATOM 1275 CZ3 TRP A 18 -9.296 7.101 6.531 1.00 0.00 C ATOM 1276 CH2 TRP A 18 -8.967 6.264 7.605 1.00 0.00 C ATOM 0 H TRP A 18 -3.830 9.834 4.644 1.00 0.00 H new ATOM 0 HA TRP A 18 -6.581 8.922 4.211 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -5.161 11.032 5.886 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -6.906 11.078 5.729 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -4.327 9.570 7.826 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -5.201 7.536 9.166 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -8.700 8.780 5.322 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -7.517 5.824 9.134 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -10.219 6.944 5.992 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -9.634 5.464 7.892 1.00 0.00 H new ATOM 1287 N ARG A 19 -7.460 10.544 2.574 1.00 0.00 N ATOM 1288 CA ARG A 19 -7.987 11.453 1.512 1.00 0.00 C ATOM 1289 C ARG A 19 -9.361 11.992 1.918 1.00 0.00 C ATOM 1290 O ARG A 19 -10.224 11.239 2.307 1.00 0.00 O ATOM 1291 CB ARG A 19 -8.151 10.631 0.218 1.00 0.00 C ATOM 1292 CG ARG A 19 -6.804 10.521 -0.531 1.00 0.00 C ATOM 1293 CD ARG A 19 -6.531 11.811 -1.316 1.00 0.00 C ATOM 1294 NE ARG A 19 -5.622 11.520 -2.479 1.00 0.00 N ATOM 1295 CZ ARG A 19 -4.422 11.019 -2.323 1.00 0.00 C ATOM 1296 NH1 ARG A 19 -3.906 10.866 -1.135 1.00 0.00 N ATOM 1297 NH2 ARG A 19 -3.715 10.711 -3.376 1.00 0.00 N ATOM 0 H ARG A 19 -8.031 9.716 2.741 1.00 0.00 H new ATOM 0 HA ARG A 19 -7.300 12.286 1.368 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -8.522 9.635 0.458 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -8.894 11.101 -0.426 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -5.997 10.341 0.180 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -6.826 9.670 -1.211 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -7.469 12.235 -1.674 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -6.074 12.555 -0.663 1.00 0.00 H new ATOM 0 HE ARG A 19 -5.952 11.720 -3.423 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -4.439 11.138 -0.309 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -2.970 10.474 -1.032 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -4.098 10.861 -4.309 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -2.779 10.320 -3.266 1.00 0.00 H new ATOM 1311 N ARG A 20 -9.596 13.272 1.826 1.00 0.00 N ATOM 1312 CA ARG A 20 -10.947 13.789 2.189 1.00 0.00 C ATOM 1313 C ARG A 20 -11.849 13.632 0.960 1.00 0.00 C ATOM 1314 O ARG A 20 -11.406 13.777 -0.163 1.00 0.00 O ATOM 1315 CB ARG A 20 -10.860 15.270 2.578 1.00 0.00 C ATOM 1316 CG ARG A 20 -9.996 15.431 3.839 1.00 0.00 C ATOM 1317 CD ARG A 20 -10.684 14.772 5.048 1.00 0.00 C ATOM 1318 NE ARG A 20 -10.288 15.484 6.308 1.00 0.00 N ATOM 1319 CZ ARG A 20 -9.034 15.698 6.610 1.00 0.00 C ATOM 1320 NH1 ARG A 20 -8.078 15.152 5.910 1.00 0.00 N ATOM 1321 NH2 ARG A 20 -8.737 16.422 7.655 1.00 0.00 N ATOM 0 H ARG A 20 -8.922 13.974 1.520 1.00 0.00 H new ATOM 0 HA ARG A 20 -11.348 13.235 3.038 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -10.432 15.846 1.757 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -11.859 15.667 2.758 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -9.018 14.978 3.678 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -9.828 16.489 4.040 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -11.767 14.806 4.925 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -10.403 13.721 5.110 1.00 0.00 H new ATOM 0 HE ARG A 20 -11.015 15.809 6.945 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -8.305 14.551 5.118 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -7.103 15.326 6.155 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -9.481 16.817 8.230 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -7.761 16.593 7.896 1.00 0.00 H new ATOM 1335 N SER A 21 -13.110 13.344 1.154 1.00 0.00 N ATOM 1336 CA SER A 21 -14.033 13.187 -0.017 1.00 0.00 C ATOM 1337 C SER A 21 -14.672 14.553 -0.327 1.00 0.00 C ATOM 1338 O SER A 21 -14.792 15.380 0.547 1.00 0.00 O ATOM 1339 CB SER A 21 -15.113 12.155 0.327 1.00 0.00 C ATOM 1340 OG SER A 21 -14.584 10.847 0.159 1.00 0.00 O ATOM 0 H SER A 21 -13.542 13.211 2.068 1.00 0.00 H new ATOM 0 HA SER A 21 -13.484 12.840 -0.893 1.00 0.00 H new ATOM 0 HB2 SER A 21 -15.451 12.294 1.354 1.00 0.00 H new ATOM 0 HB3 SER A 21 -15.982 12.293 -0.316 1.00 0.00 H new ATOM 0 HG SER A 21 -15.264 10.269 -0.246 1.00 0.00 H new ATOM 1346 N PRO A 22 -15.065 14.808 -1.559 1.00 0.00 N ATOM 1347 CA PRO A 22 -15.684 16.121 -1.917 1.00 0.00 C ATOM 1348 C PRO A 22 -16.747 16.612 -0.910 1.00 0.00 C ATOM 1349 O PRO A 22 -17.074 17.783 -0.874 1.00 0.00 O ATOM 1350 CB PRO A 22 -16.327 15.806 -3.281 1.00 0.00 C ATOM 1351 CG PRO A 22 -15.698 14.508 -3.823 1.00 0.00 C ATOM 1352 CD PRO A 22 -14.916 13.835 -2.682 1.00 0.00 C ATOM 0 HA PRO A 22 -14.953 16.929 -1.923 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -17.406 15.690 -3.175 1.00 0.00 H new ATOM 0 HB3 PRO A 22 -16.162 16.628 -3.978 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -16.472 13.839 -4.198 1.00 0.00 H new ATOM 0 HG3 PRO A 22 -15.035 14.728 -4.659 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -15.330 12.859 -2.429 1.00 0.00 H new ATOM 0 HD3 PRO A 22 -13.870 13.679 -2.946 1.00 0.00 H new ATOM 1360 N MET A 23 -17.298 15.737 -0.105 1.00 0.00 N ATOM 1361 CA MET A 23 -18.349 16.170 0.875 1.00 0.00 C ATOM 1362 C MET A 23 -17.724 16.459 2.244 1.00 0.00 C ATOM 1363 O MET A 23 -18.358 17.011 3.120 1.00 0.00 O ATOM 1364 CB MET A 23 -19.380 15.054 1.039 1.00 0.00 C ATOM 1365 CG MET A 23 -20.154 14.865 -0.266 1.00 0.00 C ATOM 1366 SD MET A 23 -21.367 13.540 -0.050 1.00 0.00 S ATOM 1367 CE MET A 23 -22.080 13.607 -1.710 1.00 0.00 C ATOM 0 H MET A 23 -17.068 14.744 -0.082 1.00 0.00 H new ATOM 0 HA MET A 23 -18.822 17.076 0.496 1.00 0.00 H new ATOM 0 HB2 MET A 23 -18.882 14.124 1.314 1.00 0.00 H new ATOM 0 HB3 MET A 23 -20.068 15.299 1.848 1.00 0.00 H new ATOM 0 HG2 MET A 23 -20.656 15.792 -0.543 1.00 0.00 H new ATOM 0 HG3 MET A 23 -19.469 14.619 -1.077 1.00 0.00 H new ATOM 0 HE1 MET A 23 -22.866 12.857 -1.799 1.00 0.00 H new ATOM 0 HE2 MET A 23 -22.502 14.597 -1.885 1.00 0.00 H new ATOM 0 HE3 MET A 23 -21.303 13.408 -2.448 1.00 0.00 H new ATOM 1377 N GLY A 24 -16.490 16.087 2.437 1.00 0.00 N ATOM 1378 CA GLY A 24 -15.820 16.330 3.752 1.00 0.00 C ATOM 1379 C GLY A 24 -15.907 15.066 4.614 1.00 0.00 C ATOM 1380 O GLY A 24 -15.877 15.130 5.827 1.00 0.00 O ATOM 0 H GLY A 24 -15.910 15.622 1.738 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -14.777 16.604 3.595 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -16.296 17.166 4.265 1.00 0.00 H new ATOM 1384 N ASP A 25 -16.012 13.914 3.998 1.00 0.00 N ATOM 1385 CA ASP A 25 -16.096 12.633 4.764 1.00 0.00 C ATOM 1386 C ASP A 25 -14.748 11.882 4.649 1.00 0.00 C ATOM 1387 O ASP A 25 -14.379 11.476 3.565 1.00 0.00 O ATOM 1388 CB ASP A 25 -17.181 11.763 4.123 1.00 0.00 C ATOM 1389 CG ASP A 25 -18.500 12.537 4.084 1.00 0.00 C ATOM 1390 OD1 ASP A 25 -18.451 13.755 4.128 1.00 0.00 O ATOM 1391 OD2 ASP A 25 -19.538 11.899 4.008 1.00 0.00 O ATOM 0 H ASP A 25 -16.043 13.806 2.984 1.00 0.00 H new ATOM 0 HA ASP A 25 -16.324 12.838 5.810 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -16.884 11.478 3.114 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -17.305 10.841 4.691 1.00 0.00 H new ATOM 1396 N PRO A 26 -14.003 11.688 5.725 1.00 0.00 N ATOM 1397 CA PRO A 26 -12.696 10.965 5.625 1.00 0.00 C ATOM 1398 C PRO A 26 -12.792 9.636 4.849 1.00 0.00 C ATOM 1399 O PRO A 26 -13.609 8.791 5.154 1.00 0.00 O ATOM 1400 CB PRO A 26 -12.356 10.725 7.108 1.00 0.00 C ATOM 1401 CG PRO A 26 -13.158 11.742 7.931 1.00 0.00 C ATOM 1402 CD PRO A 26 -14.378 12.157 7.096 1.00 0.00 C ATOM 0 HA PRO A 26 -11.944 11.528 5.071 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -12.612 9.707 7.401 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -11.287 10.848 7.282 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -13.473 11.304 8.878 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -12.544 12.610 8.170 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -15.293 11.684 7.451 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -14.544 13.234 7.126 1.00 0.00 H new ATOM 1410 N VAL A 27 -11.933 9.443 3.869 1.00 0.00 N ATOM 1411 CA VAL A 27 -11.936 8.152 3.092 1.00 0.00 C ATOM 1412 C VAL A 27 -10.504 7.638 2.949 1.00 0.00 C ATOM 1413 O VAL A 27 -9.554 8.388 3.055 1.00 0.00 O ATOM 1414 CB VAL A 27 -12.564 8.330 1.701 1.00 0.00 C ATOM 1415 CG1 VAL A 27 -14.088 8.392 1.834 1.00 0.00 C ATOM 1416 CG2 VAL A 27 -12.040 9.612 1.044 1.00 0.00 C ATOM 0 H VAL A 27 -11.231 10.121 3.573 1.00 0.00 H new ATOM 0 HA VAL A 27 -12.539 7.429 3.641 1.00 0.00 H new ATOM 0 HB VAL A 27 -12.291 7.482 1.073 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -14.534 8.518 0.848 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -14.452 7.467 2.281 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -14.364 9.235 2.468 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -12.492 9.727 0.059 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -12.298 10.470 1.664 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -10.957 9.551 0.941 1.00 0.00 H new ATOM 1426 N CYS A 28 -10.334 6.361 2.700 1.00 0.00 N ATOM 1427 CA CYS A 28 -8.961 5.811 2.543 1.00 0.00 C ATOM 1428 C CYS A 28 -8.483 6.059 1.110 1.00 0.00 C ATOM 1429 O CYS A 28 -9.270 6.237 0.202 1.00 0.00 O ATOM 1430 CB CYS A 28 -8.937 4.313 2.924 1.00 0.00 C ATOM 1431 SG CYS A 28 -9.775 3.263 1.701 1.00 0.00 S ATOM 0 H CYS A 28 -11.088 5.682 2.600 1.00 0.00 H new ATOM 0 HA CYS A 28 -8.272 6.317 3.219 1.00 0.00 H new ATOM 0 HB2 CYS A 28 -7.903 3.986 3.029 1.00 0.00 H new ATOM 0 HB3 CYS A 28 -9.413 4.182 3.896 1.00 0.00 H new ATOM 1436 N ASN A 29 -7.198 6.127 0.916 1.00 0.00 N ATOM 1437 CA ASN A 29 -6.653 6.431 -0.439 1.00 0.00 C ATOM 1438 C ASN A 29 -7.288 5.542 -1.511 1.00 0.00 C ATOM 1439 O ASN A 29 -7.594 6.002 -2.591 1.00 0.00 O ATOM 1440 CB ASN A 29 -5.141 6.206 -0.432 1.00 0.00 C ATOM 1441 CG ASN A 29 -4.569 6.556 -1.806 1.00 0.00 C ATOM 1442 OD1 ASN A 29 -4.543 5.727 -2.693 1.00 0.00 O ATOM 1443 ND2 ASN A 29 -4.094 7.753 -2.015 1.00 0.00 N ATOM 0 H ASN A 29 -6.495 5.984 1.641 1.00 0.00 H new ATOM 0 HA ASN A 29 -6.886 7.469 -0.676 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -4.674 6.822 0.336 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -4.918 5.168 -0.187 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -3.700 7.994 -2.925 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -4.117 8.448 -1.269 1.00 0.00 H new ATOM 1450 N ALA A 30 -7.485 4.288 -1.251 1.00 0.00 N ATOM 1451 CA ALA A 30 -8.093 3.425 -2.302 1.00 0.00 C ATOM 1452 C ALA A 30 -9.528 3.898 -2.620 1.00 0.00 C ATOM 1453 O ALA A 30 -9.874 4.098 -3.768 1.00 0.00 O ATOM 1454 CB ALA A 30 -8.098 1.979 -1.828 1.00 0.00 C ATOM 0 H ALA A 30 -7.257 3.823 -0.372 1.00 0.00 H new ATOM 0 HA ALA A 30 -7.502 3.498 -3.215 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -8.543 1.346 -2.596 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -7.075 1.655 -1.638 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -8.680 1.899 -0.910 1.00 0.00 H new ATOM 1460 N CYS A 31 -10.372 4.074 -1.625 1.00 0.00 N ATOM 1461 CA CYS A 31 -11.780 4.524 -1.913 1.00 0.00 C ATOM 1462 C CYS A 31 -11.760 5.844 -2.675 1.00 0.00 C ATOM 1463 O CYS A 31 -12.491 6.040 -3.608 1.00 0.00 O ATOM 1464 CB CYS A 31 -12.558 4.779 -0.612 1.00 0.00 C ATOM 1465 SG CYS A 31 -13.107 3.231 0.120 1.00 0.00 S ATOM 0 H CYS A 31 -10.153 3.928 -0.640 1.00 0.00 H new ATOM 0 HA CYS A 31 -12.257 3.734 -2.493 1.00 0.00 H new ATOM 0 HB2 CYS A 31 -11.926 5.317 0.095 1.00 0.00 H new ATOM 0 HB3 CYS A 31 -13.419 5.415 -0.817 1.00 0.00 H new ATOM 1470 N GLY A 32 -10.947 6.758 -2.267 1.00 0.00 N ATOM 1471 CA GLY A 32 -10.935 8.066 -2.963 1.00 0.00 C ATOM 1472 C GLY A 32 -10.674 7.862 -4.452 1.00 0.00 C ATOM 1473 O GLY A 32 -11.375 8.387 -5.294 1.00 0.00 O ATOM 0 H GLY A 32 -10.294 6.664 -1.489 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -11.889 8.573 -2.819 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -10.165 8.708 -2.535 1.00 0.00 H new ATOM 1477 N LEU A 33 -9.663 7.116 -4.785 1.00 0.00 N ATOM 1478 CA LEU A 33 -9.346 6.891 -6.219 1.00 0.00 C ATOM 1479 C LEU A 33 -10.443 6.052 -6.888 1.00 0.00 C ATOM 1480 O LEU A 33 -10.961 6.420 -7.920 1.00 0.00 O ATOM 1481 CB LEU A 33 -7.999 6.173 -6.311 1.00 0.00 C ATOM 1482 CG LEU A 33 -6.928 6.996 -5.577 1.00 0.00 C ATOM 1483 CD1 LEU A 33 -5.623 6.198 -5.515 1.00 0.00 C ATOM 1484 CD2 LEU A 33 -6.685 8.329 -6.307 1.00 0.00 C ATOM 0 H LEU A 33 -9.040 6.651 -4.124 1.00 0.00 H new ATOM 0 HA LEU A 33 -9.294 7.848 -6.738 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -8.074 5.179 -5.871 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.717 6.039 -7.355 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.276 7.207 -4.566 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -4.864 6.782 -4.995 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -5.793 5.264 -4.979 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.282 5.979 -6.527 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.924 8.901 -5.776 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -6.346 8.130 -7.324 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -7.613 8.901 -6.339 1.00 0.00 H new ATOM 1496 N TYR A 34 -10.815 4.932 -6.323 1.00 0.00 N ATOM 1497 CA TYR A 34 -11.884 4.112 -6.970 1.00 0.00 C ATOM 1498 C TYR A 34 -13.163 4.936 -7.067 1.00 0.00 C ATOM 1499 O TYR A 34 -13.829 4.962 -8.083 1.00 0.00 O ATOM 1500 CB TYR A 34 -12.175 2.862 -6.131 1.00 0.00 C ATOM 1501 CG TYR A 34 -13.260 2.052 -6.801 1.00 0.00 C ATOM 1502 CD1 TYR A 34 -14.603 2.409 -6.629 1.00 0.00 C ATOM 1503 CD2 TYR A 34 -12.926 0.950 -7.597 1.00 0.00 C ATOM 1504 CE1 TYR A 34 -15.611 1.665 -7.252 1.00 0.00 C ATOM 1505 CE2 TYR A 34 -13.936 0.204 -8.219 1.00 0.00 C ATOM 1506 CZ TYR A 34 -15.278 0.563 -8.049 1.00 0.00 C ATOM 1507 OH TYR A 34 -16.273 -0.169 -8.665 1.00 0.00 O ATOM 0 H TYR A 34 -10.433 4.554 -5.456 1.00 0.00 H new ATOM 0 HA TYR A 34 -11.545 3.815 -7.962 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -11.271 2.263 -6.025 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -12.487 3.149 -5.127 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -14.861 3.259 -6.015 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -11.890 0.675 -7.732 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -16.647 1.941 -7.118 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -13.679 -0.649 -8.830 1.00 0.00 H new ATOM 0 HH TYR A 34 -15.871 -0.899 -9.181 1.00 0.00 H new ATOM 1517 N TYR A 35 -13.516 5.593 -6.003 1.00 0.00 N ATOM 1518 CA TYR A 35 -14.756 6.411 -5.986 1.00 0.00 C ATOM 1519 C TYR A 35 -14.673 7.535 -7.022 1.00 0.00 C ATOM 1520 O TYR A 35 -15.592 7.778 -7.756 1.00 0.00 O ATOM 1521 CB TYR A 35 -14.928 7.023 -4.593 1.00 0.00 C ATOM 1522 CG TYR A 35 -16.347 7.490 -4.421 1.00 0.00 C ATOM 1523 CD1 TYR A 35 -16.721 8.766 -4.849 1.00 0.00 C ATOM 1524 CD2 TYR A 35 -17.288 6.639 -3.834 1.00 0.00 C ATOM 1525 CE1 TYR A 35 -18.043 9.194 -4.687 1.00 0.00 C ATOM 1526 CE2 TYR A 35 -18.607 7.061 -3.671 1.00 0.00 C ATOM 1527 CZ TYR A 35 -18.989 8.342 -4.096 1.00 0.00 C ATOM 1528 OH TYR A 35 -20.292 8.765 -3.935 1.00 0.00 O ATOM 0 H TYR A 35 -12.989 5.598 -5.130 1.00 0.00 H new ATOM 0 HA TYR A 35 -15.606 5.773 -6.228 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -14.681 6.287 -3.828 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -14.241 7.859 -4.464 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -15.992 9.420 -5.304 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -16.993 5.653 -3.506 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -18.336 10.180 -5.017 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -19.333 6.402 -3.218 1.00 0.00 H new ATOM 0 HH TYR A 35 -20.817 8.054 -3.511 1.00 0.00 H new ATOM 1538 N LYS A 36 -13.594 8.243 -7.077 1.00 0.00 N ATOM 1539 CA LYS A 36 -13.511 9.364 -8.055 1.00 0.00 C ATOM 1540 C LYS A 36 -13.677 8.844 -9.485 1.00 0.00 C ATOM 1541 O LYS A 36 -14.343 9.455 -10.296 1.00 0.00 O ATOM 1542 CB LYS A 36 -12.138 10.027 -7.907 1.00 0.00 C ATOM 1543 CG LYS A 36 -11.978 11.157 -8.926 1.00 0.00 C ATOM 1544 CD LYS A 36 -10.668 11.913 -8.659 1.00 0.00 C ATOM 1545 CE LYS A 36 -9.463 11.077 -9.117 1.00 0.00 C ATOM 1546 NZ LYS A 36 -8.243 11.933 -9.140 1.00 0.00 N ATOM 0 H LYS A 36 -12.768 8.103 -6.496 1.00 0.00 H new ATOM 0 HA LYS A 36 -14.308 10.081 -7.858 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -12.024 10.421 -6.897 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -11.352 9.286 -8.050 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -11.975 10.750 -9.937 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -12.824 11.841 -8.861 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -10.678 12.867 -9.186 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -10.580 12.137 -7.596 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -9.315 10.233 -8.443 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -9.649 10.664 -10.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -7.428 11.367 -9.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -8.386 12.724 -9.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -8.063 12.306 -8.186 1.00 0.00 H new ATOM 1560 N LEU A 37 -13.080 7.740 -9.810 1.00 0.00 N ATOM 1561 CA LEU A 37 -13.211 7.215 -11.198 1.00 0.00 C ATOM 1562 C LEU A 37 -14.637 6.698 -11.476 1.00 0.00 C ATOM 1563 O LEU A 37 -15.149 6.877 -12.564 1.00 0.00 O ATOM 1564 CB LEU A 37 -12.183 6.085 -11.402 1.00 0.00 C ATOM 1565 CG LEU A 37 -10.858 6.658 -11.923 1.00 0.00 C ATOM 1566 CD1 LEU A 37 -10.274 7.639 -10.904 1.00 0.00 C ATOM 1567 CD2 LEU A 37 -9.871 5.513 -12.150 1.00 0.00 C ATOM 0 H LEU A 37 -12.508 7.177 -9.181 1.00 0.00 H new ATOM 0 HA LEU A 37 -13.019 8.027 -11.900 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -12.016 5.562 -10.460 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -12.573 5.352 -12.109 1.00 0.00 H new ATOM 0 HG LEU A 37 -11.037 7.185 -12.860 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -9.334 8.040 -11.283 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -10.977 8.455 -10.740 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -10.094 7.121 -9.962 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -8.927 5.914 -12.520 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -9.699 4.989 -11.210 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -10.282 4.818 -12.882 1.00 0.00 H new ATOM 1579 N HIS A 38 -15.269 6.028 -10.532 1.00 0.00 N ATOM 1580 CA HIS A 38 -16.646 5.466 -10.792 1.00 0.00 C ATOM 1581 C HIS A 38 -17.698 6.034 -9.822 1.00 0.00 C ATOM 1582 O HIS A 38 -18.817 5.568 -9.795 1.00 0.00 O ATOM 1583 CB HIS A 38 -16.585 3.946 -10.631 1.00 0.00 C ATOM 1584 CG HIS A 38 -15.532 3.392 -11.554 1.00 0.00 C ATOM 1585 ND1 HIS A 38 -15.846 2.767 -12.751 1.00 0.00 N ATOM 1586 CD2 HIS A 38 -14.161 3.374 -11.469 1.00 0.00 C ATOM 1587 CE1 HIS A 38 -14.687 2.403 -13.333 1.00 0.00 C ATOM 1588 NE2 HIS A 38 -13.630 2.749 -12.592 1.00 0.00 N ATOM 0 H HIS A 38 -14.896 5.846 -9.600 1.00 0.00 H new ATOM 0 HA HIS A 38 -16.945 5.747 -11.802 1.00 0.00 H new ATOM 0 HB2 HIS A 38 -16.353 3.687 -9.598 1.00 0.00 H new ATOM 0 HB3 HIS A 38 -17.555 3.505 -10.860 1.00 0.00 H new ATOM 0 HD1 HIS A 38 -16.783 2.611 -13.123 1.00 0.00 H new ATOM 0 HD2 HIS A 38 -13.583 3.783 -10.654 1.00 0.00 H new ATOM 0 HE1 HIS A 38 -14.620 1.894 -14.283 1.00 0.00 H new ATOM 1596 N GLN A 39 -17.369 7.026 -9.036 1.00 0.00 N ATOM 1597 CA GLN A 39 -18.344 7.637 -8.067 1.00 0.00 C ATOM 1598 C GLN A 39 -19.354 6.631 -7.490 1.00 0.00 C ATOM 1599 O GLN A 39 -20.513 6.940 -7.293 1.00 0.00 O ATOM 1600 CB GLN A 39 -19.034 8.845 -8.713 1.00 0.00 C ATOM 1601 CG GLN A 39 -19.982 8.397 -9.836 1.00 0.00 C ATOM 1602 CD GLN A 39 -20.747 9.612 -10.370 1.00 0.00 C ATOM 1603 OE1 GLN A 39 -20.632 10.699 -9.839 1.00 0.00 O ATOM 1604 NE2 GLN A 39 -21.531 9.473 -11.406 1.00 0.00 N ATOM 0 H GLN A 39 -16.443 7.453 -9.021 1.00 0.00 H new ATOM 0 HA GLN A 39 -17.771 7.978 -7.205 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -19.593 9.397 -7.957 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -18.284 9.526 -9.115 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -19.415 7.928 -10.640 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -20.681 7.649 -9.461 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -21.629 8.561 -11.853 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -22.045 10.276 -11.768 1.00 0.00 H new ATOM 1613 N VAL A 40 -18.904 5.449 -7.149 1.00 0.00 N ATOM 1614 CA VAL A 40 -19.798 4.438 -6.514 1.00 0.00 C ATOM 1615 C VAL A 40 -19.014 3.754 -5.389 1.00 0.00 C ATOM 1616 O VAL A 40 -17.799 3.753 -5.382 1.00 0.00 O ATOM 1617 CB VAL A 40 -20.265 3.403 -7.542 1.00 0.00 C ATOM 1618 CG1 VAL A 40 -21.260 4.065 -8.505 1.00 0.00 C ATOM 1619 CG2 VAL A 40 -19.062 2.815 -8.322 1.00 0.00 C ATOM 0 H VAL A 40 -17.942 5.140 -7.287 1.00 0.00 H new ATOM 0 HA VAL A 40 -20.686 4.927 -6.114 1.00 0.00 H new ATOM 0 HB VAL A 40 -20.755 2.580 -7.022 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -21.597 3.334 -9.240 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -22.117 4.437 -7.944 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -20.774 4.896 -9.016 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -19.420 2.083 -9.046 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -18.541 3.617 -8.845 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -18.378 2.331 -7.625 1.00 0.00 H new ATOM 1629 N ASN A 41 -19.693 3.200 -4.422 1.00 0.00 N ATOM 1630 CA ASN A 41 -18.977 2.549 -3.277 1.00 0.00 C ATOM 1631 C ASN A 41 -18.594 1.101 -3.630 1.00 0.00 C ATOM 1632 O ASN A 41 -19.418 0.319 -4.062 1.00 0.00 O ATOM 1633 CB ASN A 41 -19.895 2.550 -2.051 1.00 0.00 C ATOM 1634 CG ASN A 41 -21.266 2.000 -2.450 1.00 0.00 C ATOM 1635 OD1 ASN A 41 -21.445 1.532 -3.556 1.00 0.00 O ATOM 1636 ND2 ASN A 41 -22.250 2.040 -1.593 1.00 0.00 N ATOM 0 H ASN A 41 -20.711 3.168 -4.371 1.00 0.00 H new ATOM 0 HA ASN A 41 -18.065 3.107 -3.065 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -19.462 1.941 -1.257 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -19.996 3.562 -1.658 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -23.168 1.678 -1.853 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -22.101 2.433 -0.664 1.00 0.00 H new ATOM 1643 N ARG A 42 -17.338 0.742 -3.460 1.00 0.00 N ATOM 1644 CA ARG A 42 -16.880 -0.648 -3.797 1.00 0.00 C ATOM 1645 C ARG A 42 -16.958 -1.563 -2.543 1.00 0.00 C ATOM 1646 O ARG A 42 -16.518 -1.168 -1.480 1.00 0.00 O ATOM 1647 CB ARG A 42 -15.421 -0.575 -4.269 1.00 0.00 C ATOM 1648 CG ARG A 42 -15.019 -1.890 -4.950 1.00 0.00 C ATOM 1649 CD ARG A 42 -13.560 -1.810 -5.459 1.00 0.00 C ATOM 1650 NE ARG A 42 -13.478 -2.354 -6.854 1.00 0.00 N ATOM 1651 CZ ARG A 42 -14.030 -3.497 -7.169 1.00 0.00 C ATOM 1652 NH1 ARG A 42 -14.562 -4.247 -6.244 1.00 0.00 N ATOM 1653 NH2 ARG A 42 -14.018 -3.906 -8.408 1.00 0.00 N ATOM 0 H ARG A 42 -16.608 1.357 -3.100 1.00 0.00 H new ATOM 0 HA ARG A 42 -17.521 -1.062 -4.576 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -15.297 0.256 -4.964 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -14.766 -0.381 -3.420 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -15.121 -2.717 -4.247 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -15.691 -2.096 -5.783 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -13.215 -0.776 -5.441 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -12.903 -2.376 -4.799 1.00 0.00 H new ATOM 0 HE ARG A 42 -12.983 -1.823 -7.570 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -14.549 -3.943 -5.271 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -14.991 -5.138 -6.494 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -13.578 -3.334 -9.129 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -14.448 -4.797 -8.655 1.00 0.00 H new ATOM 1667 N PRO A 43 -17.492 -2.778 -2.642 1.00 0.00 N ATOM 1668 CA PRO A 43 -17.571 -3.691 -1.456 1.00 0.00 C ATOM 1669 C PRO A 43 -16.281 -3.720 -0.618 1.00 0.00 C ATOM 1670 O PRO A 43 -15.195 -3.498 -1.113 1.00 0.00 O ATOM 1671 CB PRO A 43 -17.845 -5.051 -2.114 1.00 0.00 C ATOM 1672 CG PRO A 43 -18.417 -4.784 -3.515 1.00 0.00 C ATOM 1673 CD PRO A 43 -18.054 -3.338 -3.910 1.00 0.00 C ATOM 0 HA PRO A 43 -18.329 -3.377 -0.738 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -16.928 -5.636 -2.180 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -18.550 -5.630 -1.517 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -18.006 -5.491 -4.236 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -19.499 -4.920 -3.517 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -17.326 -3.311 -4.721 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -18.927 -2.779 -4.246 1.00 0.00 H new ATOM 1681 N LEU A 44 -16.412 -3.987 0.655 1.00 0.00 N ATOM 1682 CA LEU A 44 -15.220 -4.029 1.554 1.00 0.00 C ATOM 1683 C LEU A 44 -14.355 -5.245 1.239 1.00 0.00 C ATOM 1684 O LEU A 44 -13.158 -5.225 1.443 1.00 0.00 O ATOM 1685 CB LEU A 44 -15.678 -4.105 3.015 1.00 0.00 C ATOM 1686 CG LEU A 44 -16.377 -2.784 3.425 1.00 0.00 C ATOM 1687 CD1 LEU A 44 -17.901 -2.928 3.310 1.00 0.00 C ATOM 1688 CD2 LEU A 44 -16.022 -2.431 4.876 1.00 0.00 C ATOM 0 H LEU A 44 -17.302 -4.180 1.115 1.00 0.00 H new ATOM 0 HA LEU A 44 -14.634 -3.124 1.394 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -16.362 -4.943 3.146 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -14.821 -4.288 3.663 1.00 0.00 H new ATOM 0 HG LEU A 44 -16.035 -1.994 2.757 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -18.378 -1.992 3.601 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -18.167 -3.166 2.280 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -18.241 -3.728 3.967 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -16.517 -1.501 5.156 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -16.353 -3.232 5.537 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -14.943 -2.309 4.967 1.00 0.00 H new ATOM 1700 N THR A 45 -14.942 -6.304 0.758 1.00 0.00 N ATOM 1701 CA THR A 45 -14.136 -7.521 0.440 1.00 0.00 C ATOM 1702 C THR A 45 -12.882 -7.115 -0.347 1.00 0.00 C ATOM 1703 O THR A 45 -11.964 -7.891 -0.516 1.00 0.00 O ATOM 1704 CB THR A 45 -14.969 -8.496 -0.402 1.00 0.00 C ATOM 1705 OG1 THR A 45 -15.148 -7.963 -1.707 1.00 0.00 O ATOM 1706 CG2 THR A 45 -16.336 -8.723 0.249 1.00 0.00 C ATOM 0 H THR A 45 -15.942 -6.383 0.571 1.00 0.00 H new ATOM 0 HA THR A 45 -13.845 -8.008 1.371 1.00 0.00 H new ATOM 0 HB THR A 45 -14.443 -9.449 -0.464 1.00 0.00 H new ATOM 0 HG1 THR A 45 -15.679 -8.587 -2.245 1.00 0.00 H new ATOM 0 HG21 THR A 45 -16.917 -9.417 -0.358 1.00 0.00 H new ATOM 0 HG22 THR A 45 -16.199 -9.141 1.246 1.00 0.00 H new ATOM 0 HG23 THR A 45 -16.866 -7.773 0.323 1.00 0.00 H new ATOM 1714 N MET A 46 -12.838 -5.897 -0.826 1.00 0.00 N ATOM 1715 CA MET A 46 -11.647 -5.431 -1.597 1.00 0.00 C ATOM 1716 C MET A 46 -10.440 -5.278 -0.655 1.00 0.00 C ATOM 1717 O MET A 46 -9.345 -5.714 -0.952 1.00 0.00 O ATOM 1718 CB MET A 46 -11.987 -4.072 -2.234 1.00 0.00 C ATOM 1719 CG MET A 46 -10.820 -3.545 -3.084 1.00 0.00 C ATOM 1720 SD MET A 46 -10.824 -4.357 -4.703 1.00 0.00 S ATOM 1721 CE MET A 46 -10.016 -3.021 -5.623 1.00 0.00 C ATOM 0 H MET A 46 -13.578 -5.204 -0.715 1.00 0.00 H new ATOM 0 HA MET A 46 -11.394 -6.156 -2.370 1.00 0.00 H new ATOM 0 HB2 MET A 46 -12.876 -4.172 -2.856 1.00 0.00 H new ATOM 0 HB3 MET A 46 -12.225 -3.351 -1.452 1.00 0.00 H new ATOM 0 HG2 MET A 46 -10.907 -2.466 -3.208 1.00 0.00 H new ATOM 0 HG3 MET A 46 -9.874 -3.732 -2.575 1.00 0.00 H new ATOM 0 HE1 MET A 46 -9.611 -3.415 -6.555 1.00 0.00 H new ATOM 0 HE2 MET A 46 -10.744 -2.240 -5.845 1.00 0.00 H new ATOM 0 HE3 MET A 46 -9.207 -2.604 -5.023 1.00 0.00 H new ATOM 1731 N ARG A 47 -10.635 -4.644 0.467 1.00 0.00 N ATOM 1732 CA ARG A 47 -9.509 -4.433 1.431 1.00 0.00 C ATOM 1733 C ARG A 47 -9.300 -5.660 2.319 1.00 0.00 C ATOM 1734 O ARG A 47 -10.093 -6.580 2.337 1.00 0.00 O ATOM 1735 CB ARG A 47 -9.802 -3.221 2.321 1.00 0.00 C ATOM 1736 CG ARG A 47 -9.812 -1.919 1.478 1.00 0.00 C ATOM 1737 CD ARG A 47 -11.251 -1.445 1.262 1.00 0.00 C ATOM 1738 NE ARG A 47 -11.265 -0.394 0.206 1.00 0.00 N ATOM 1739 CZ ARG A 47 -12.394 -0.004 -0.321 1.00 0.00 C ATOM 1740 NH1 ARG A 47 -13.520 -0.520 0.091 1.00 0.00 N ATOM 1741 NH2 ARG A 47 -12.396 0.903 -1.258 1.00 0.00 N ATOM 0 H ARG A 47 -11.532 -4.258 0.764 1.00 0.00 H new ATOM 0 HA ARG A 47 -8.603 -4.262 0.849 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -10.765 -3.349 2.815 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -9.049 -3.148 3.106 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -9.237 -1.144 1.985 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -9.330 -2.095 0.516 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -11.883 -2.283 0.967 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -11.660 -1.049 2.192 1.00 0.00 H new ATOM 0 HE ARG A 47 -10.388 0.023 -0.107 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -13.518 -1.228 0.825 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -14.402 -0.215 -0.321 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -11.516 1.307 -1.579 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -13.278 1.208 -1.670 1.00 0.00 H new ATOM 1755 N LYS A 48 -8.233 -5.653 3.079 1.00 0.00 N ATOM 1756 CA LYS A 48 -7.938 -6.782 4.011 1.00 0.00 C ATOM 1757 C LYS A 48 -7.414 -6.194 5.328 1.00 0.00 C ATOM 1758 O LYS A 48 -7.124 -5.016 5.410 1.00 0.00 O ATOM 1759 CB LYS A 48 -6.883 -7.710 3.398 1.00 0.00 C ATOM 1760 CG LYS A 48 -7.471 -8.412 2.170 1.00 0.00 C ATOM 1761 CD LYS A 48 -6.417 -9.339 1.558 1.00 0.00 C ATOM 1762 CE LYS A 48 -6.998 -10.046 0.329 1.00 0.00 C ATOM 1763 NZ LYS A 48 -8.076 -10.984 0.749 1.00 0.00 N ATOM 0 H LYS A 48 -7.544 -4.901 3.092 1.00 0.00 H new ATOM 0 HA LYS A 48 -8.843 -7.362 4.191 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -6.000 -7.137 3.114 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -6.562 -8.448 4.133 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -8.354 -8.985 2.453 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -7.792 -7.674 1.435 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -5.535 -8.765 1.275 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -6.096 -10.075 2.294 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -7.395 -9.311 -0.371 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -6.212 -10.591 -0.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -8.267 -11.659 -0.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -7.774 -11.502 1.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -8.941 -10.447 0.961 1.00 0.00 H new ATOM 1777 N ASP A 49 -7.322 -6.993 6.361 1.00 0.00 N ATOM 1778 CA ASP A 49 -6.845 -6.483 7.688 1.00 0.00 C ATOM 1779 C ASP A 49 -5.710 -5.465 7.519 1.00 0.00 C ATOM 1780 O ASP A 49 -5.936 -4.271 7.473 1.00 0.00 O ATOM 1781 CB ASP A 49 -6.341 -7.664 8.527 1.00 0.00 C ATOM 1782 CG ASP A 49 -5.514 -8.598 7.643 1.00 0.00 C ATOM 1783 OD1 ASP A 49 -6.110 -9.376 6.917 1.00 0.00 O ATOM 1784 OD2 ASP A 49 -4.298 -8.518 7.705 1.00 0.00 O ATOM 0 H ASP A 49 -7.558 -7.985 6.344 1.00 0.00 H new ATOM 0 HA ASP A 49 -7.678 -5.987 8.186 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -5.736 -7.302 9.358 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -7.184 -8.204 8.958 1.00 0.00 H new ATOM 1789 N GLY A 50 -4.492 -5.924 7.449 1.00 0.00 N ATOM 1790 CA GLY A 50 -3.344 -4.980 7.310 1.00 0.00 C ATOM 1791 C GLY A 50 -3.366 -4.329 5.928 1.00 0.00 C ATOM 1792 O GLY A 50 -4.283 -4.523 5.155 1.00 0.00 O ATOM 0 H GLY A 50 -4.240 -6.912 7.482 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -3.398 -4.213 8.083 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -2.405 -5.513 7.455 1.00 0.00 H new ATOM 1796 N ILE A 51 -2.354 -3.563 5.604 1.00 0.00 N ATOM 1797 CA ILE A 51 -2.304 -2.910 4.271 1.00 0.00 C ATOM 1798 C ILE A 51 -1.607 -3.845 3.282 1.00 0.00 C ATOM 1799 O ILE A 51 -0.637 -4.503 3.602 1.00 0.00 O ATOM 1800 CB ILE A 51 -1.539 -1.587 4.377 1.00 0.00 C ATOM 1801 CG1 ILE A 51 -2.165 -0.747 5.513 1.00 0.00 C ATOM 1802 CG2 ILE A 51 -1.626 -0.826 3.038 1.00 0.00 C ATOM 1803 CD1 ILE A 51 -1.810 0.740 5.355 1.00 0.00 C ATOM 0 H ILE A 51 -1.559 -3.364 6.212 1.00 0.00 H new ATOM 0 HA ILE A 51 -3.315 -2.704 3.920 1.00 0.00 H new ATOM 0 HB ILE A 51 -0.489 -1.776 4.598 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.248 -0.869 5.507 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -1.809 -1.110 6.477 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -1.081 0.114 3.118 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -1.189 -1.433 2.245 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -2.670 -0.621 2.803 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.262 1.310 6.166 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.727 0.861 5.386 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -2.189 1.105 4.400 1.00 0.00 H new ATOM 1815 N GLN A 52 -2.101 -3.901 2.081 1.00 0.00 N ATOM 1816 CA GLN A 52 -1.484 -4.782 1.051 1.00 0.00 C ATOM 1817 C GLN A 52 -0.176 -4.143 0.563 1.00 0.00 C ATOM 1818 O GLN A 52 -0.050 -2.938 0.532 1.00 0.00 O ATOM 1819 CB GLN A 52 -2.460 -4.926 -0.122 1.00 0.00 C ATOM 1820 CG GLN A 52 -3.684 -5.728 0.320 1.00 0.00 C ATOM 1821 CD GLN A 52 -4.679 -5.807 -0.840 1.00 0.00 C ATOM 1822 OE1 GLN A 52 -5.099 -6.881 -1.224 1.00 0.00 O ATOM 1823 NE2 GLN A 52 -5.069 -4.705 -1.424 1.00 0.00 N ATOM 0 H GLN A 52 -2.913 -3.371 1.764 1.00 0.00 H new ATOM 0 HA GLN A 52 -1.270 -5.764 1.472 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.767 -3.941 -0.475 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -1.969 -5.425 -0.957 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -3.385 -6.730 0.628 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -4.151 -5.255 1.184 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -4.716 -3.804 -1.101 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -5.726 -4.746 -2.203 1.00 0.00 H new ATOM 1832 N THR A 53 0.808 -4.933 0.201 1.00 0.00 N ATOM 1833 CA THR A 53 2.108 -4.343 -0.274 1.00 0.00 C ATOM 1834 C THR A 53 2.666 -5.148 -1.451 1.00 0.00 C ATOM 1835 O THR A 53 2.345 -6.301 -1.649 1.00 0.00 O ATOM 1836 CB THR A 53 3.131 -4.331 0.865 1.00 0.00 C ATOM 1837 OG1 THR A 53 4.443 -4.390 0.323 1.00 0.00 O ATOM 1838 CG2 THR A 53 2.897 -5.528 1.774 1.00 0.00 C ATOM 0 H THR A 53 0.771 -5.952 0.212 1.00 0.00 H new ATOM 0 HA THR A 53 1.919 -3.321 -0.601 1.00 0.00 H new ATOM 0 HB THR A 53 3.020 -3.414 1.444 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.099 -4.381 1.051 1.00 0.00 H new ATOM 0 HG21 THR A 53 3.626 -5.518 2.584 1.00 0.00 H new ATOM 0 HG22 THR A 53 1.891 -5.477 2.191 1.00 0.00 H new ATOM 0 HG23 THR A 53 3.006 -6.448 1.200 1.00 0.00 H new ATOM 1846 N ARG A 54 3.512 -4.520 -2.224 1.00 0.00 N ATOM 1847 CA ARG A 54 4.140 -5.184 -3.413 1.00 0.00 C ATOM 1848 C ARG A 54 5.551 -4.622 -3.614 1.00 0.00 C ATOM 1849 O ARG A 54 5.910 -3.608 -3.050 1.00 0.00 O ATOM 1850 CB ARG A 54 3.315 -4.912 -4.690 1.00 0.00 C ATOM 1851 CG ARG A 54 1.879 -5.464 -4.574 1.00 0.00 C ATOM 1852 CD ARG A 54 1.886 -7.000 -4.598 1.00 0.00 C ATOM 1853 NE ARG A 54 0.488 -7.506 -4.706 1.00 0.00 N ATOM 1854 CZ ARG A 54 0.271 -8.752 -5.030 1.00 0.00 C ATOM 1855 NH1 ARG A 54 1.279 -9.548 -5.266 1.00 0.00 N ATOM 1856 NH2 ARG A 54 -0.951 -9.203 -5.122 1.00 0.00 N ATOM 0 H ARG A 54 3.803 -3.553 -2.081 1.00 0.00 H new ATOM 0 HA ARG A 54 4.175 -6.258 -3.233 1.00 0.00 H new ATOM 0 HB2 ARG A 54 3.278 -3.839 -4.877 1.00 0.00 H new ATOM 0 HB3 ARG A 54 3.811 -5.368 -5.547 1.00 0.00 H new ATOM 0 HG2 ARG A 54 1.422 -5.112 -3.649 1.00 0.00 H new ATOM 0 HG3 ARG A 54 1.271 -5.085 -5.395 1.00 0.00 H new ATOM 0 HD2 ARG A 54 2.479 -7.358 -5.440 1.00 0.00 H new ATOM 0 HD3 ARG A 54 2.354 -7.386 -3.692 1.00 0.00 H new ATOM 0 HE ARG A 54 -0.297 -6.880 -4.527 1.00 0.00 H new ATOM 0 HH11 ARG A 54 2.234 -9.196 -5.197 1.00 0.00 H new ATOM 0 HH12 ARG A 54 1.111 -10.522 -5.519 1.00 0.00 H new ATOM 0 HH21 ARG A 54 -1.739 -8.581 -4.941 1.00 0.00 H new ATOM 0 HH22 ARG A 54 -1.117 -10.177 -5.375 1.00 0.00 H new ATOM 1870 N ASN A 55 6.357 -5.275 -4.413 1.00 0.00 N ATOM 1871 CA ASN A 55 7.743 -4.767 -4.638 1.00 0.00 C ATOM 1872 C ASN A 55 7.673 -3.281 -4.995 1.00 0.00 C ATOM 1873 O ASN A 55 6.802 -2.838 -5.716 1.00 0.00 O ATOM 1874 CB ASN A 55 8.421 -5.548 -5.766 1.00 0.00 C ATOM 1875 CG ASN A 55 9.883 -5.108 -5.888 1.00 0.00 C ATOM 1876 OD1 ASN A 55 10.357 -4.308 -5.106 1.00 0.00 O ATOM 1877 ND2 ASN A 55 10.623 -5.603 -6.843 1.00 0.00 N ATOM 0 H ASN A 55 6.118 -6.130 -4.915 1.00 0.00 H new ATOM 0 HA ASN A 55 8.331 -4.901 -3.730 1.00 0.00 H new ATOM 0 HB2 ASN A 55 8.368 -6.618 -5.564 1.00 0.00 H new ATOM 0 HB3 ASN A 55 7.899 -5.375 -6.707 1.00 0.00 H new ATOM 0 HD21 ASN A 55 11.598 -5.318 -6.932 1.00 0.00 H new ATOM 0 HD22 ASN A 55 10.226 -6.275 -7.500 1.00 0.00 H new ATOM 1884 N ARG A 56 8.572 -2.513 -4.449 1.00 0.00 N ATOM 1885 CA ARG A 56 8.573 -1.042 -4.687 1.00 0.00 C ATOM 1886 C ARG A 56 8.850 -0.708 -6.157 1.00 0.00 C ATOM 1887 O ARG A 56 9.768 -1.217 -6.767 1.00 0.00 O ATOM 1888 CB ARG A 56 9.652 -0.408 -3.815 1.00 0.00 C ATOM 1889 CG ARG A 56 9.496 1.109 -3.848 1.00 0.00 C ATOM 1890 CD ARG A 56 10.569 1.750 -2.973 1.00 0.00 C ATOM 1891 NE ARG A 56 10.395 1.302 -1.562 1.00 0.00 N ATOM 1892 CZ ARG A 56 11.356 1.485 -0.700 1.00 0.00 C ATOM 1893 NH1 ARG A 56 12.483 2.015 -1.086 1.00 0.00 N ATOM 1894 NH2 ARG A 56 11.195 1.127 0.546 1.00 0.00 N ATOM 0 H ARG A 56 9.318 -2.846 -3.838 1.00 0.00 H new ATOM 0 HA ARG A 56 7.588 -0.650 -4.434 1.00 0.00 H new ATOM 0 HB2 ARG A 56 9.569 -0.772 -2.791 1.00 0.00 H new ATOM 0 HB3 ARG A 56 10.641 -0.692 -4.175 1.00 0.00 H new ATOM 0 HG2 ARG A 56 9.582 1.472 -4.872 1.00 0.00 H new ATOM 0 HG3 ARG A 56 8.505 1.391 -3.492 1.00 0.00 H new ATOM 0 HD2 ARG A 56 11.560 1.474 -3.334 1.00 0.00 H new ATOM 0 HD3 ARG A 56 10.500 2.836 -3.032 1.00 0.00 H new ATOM 0 HE ARG A 56 9.526 0.853 -1.272 1.00 0.00 H new ATOM 0 HH11 ARG A 56 12.612 2.286 -2.061 1.00 0.00 H new ATOM 0 HH12 ARG A 56 13.236 2.159 -0.413 1.00 0.00 H new ATOM 0 HH21 ARG A 56 10.317 0.704 0.846 1.00 0.00 H new ATOM 0 HH22 ARG A 56 11.948 1.271 1.219 1.00 0.00 H new ATOM 1908 N LYS A 57 8.043 0.151 -6.723 1.00 0.00 N ATOM 1909 CA LYS A 57 8.215 0.548 -8.152 1.00 0.00 C ATOM 1910 C LYS A 57 9.685 0.903 -8.434 1.00 0.00 C ATOM 1911 O LYS A 57 10.450 1.200 -7.537 1.00 0.00 O ATOM 1912 CB LYS A 57 7.339 1.778 -8.431 1.00 0.00 C ATOM 1913 CG LYS A 57 7.090 1.914 -9.940 1.00 0.00 C ATOM 1914 CD LYS A 57 6.703 3.349 -10.282 1.00 0.00 C ATOM 1915 CE LYS A 57 5.529 3.802 -9.409 1.00 0.00 C ATOM 1916 NZ LYS A 57 4.448 2.779 -9.463 1.00 0.00 N ATOM 0 H LYS A 57 7.260 0.601 -6.248 1.00 0.00 H new ATOM 0 HA LYS A 57 7.922 -0.283 -8.794 1.00 0.00 H new ATOM 0 HB2 LYS A 57 6.389 1.685 -7.904 1.00 0.00 H new ATOM 0 HB3 LYS A 57 7.827 2.676 -8.052 1.00 0.00 H new ATOM 0 HG2 LYS A 57 7.987 1.630 -10.491 1.00 0.00 H new ATOM 0 HG3 LYS A 57 6.297 1.232 -10.248 1.00 0.00 H new ATOM 0 HD2 LYS A 57 7.556 4.010 -10.129 1.00 0.00 H new ATOM 0 HD3 LYS A 57 6.431 3.419 -11.335 1.00 0.00 H new ATOM 0 HE2 LYS A 57 5.860 3.943 -8.380 1.00 0.00 H new ATOM 0 HE3 LYS A 57 5.152 4.764 -9.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 3.534 3.248 -9.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 4.639 2.113 -10.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 4.415 2.261 -8.562 1.00 0.00 H new ATOM 1930 N VAL A 58 10.071 0.888 -9.684 1.00 0.00 N ATOM 1931 CA VAL A 58 11.472 1.232 -10.056 1.00 0.00 C ATOM 1932 C VAL A 58 11.784 2.661 -9.598 1.00 0.00 C ATOM 1933 O VAL A 58 10.932 3.527 -9.618 1.00 0.00 O ATOM 1934 CB VAL A 58 11.617 1.151 -11.579 1.00 0.00 C ATOM 1935 CG1 VAL A 58 13.005 1.640 -11.995 1.00 0.00 C ATOM 1936 CG2 VAL A 58 11.438 -0.300 -12.030 1.00 0.00 C ATOM 0 H VAL A 58 9.466 0.649 -10.470 1.00 0.00 H new ATOM 0 HA VAL A 58 12.161 0.536 -9.578 1.00 0.00 H new ATOM 0 HB VAL A 58 10.858 1.779 -12.045 1.00 0.00 H new ATOM 0 HG11 VAL A 58 13.102 1.580 -13.079 1.00 0.00 H new ATOM 0 HG12 VAL A 58 13.137 2.674 -11.675 1.00 0.00 H new ATOM 0 HG13 VAL A 58 13.766 1.015 -11.527 1.00 0.00 H new ATOM 0 HG21 VAL A 58 11.541 -0.360 -13.114 1.00 0.00 H new ATOM 0 HG22 VAL A 58 12.197 -0.924 -11.559 1.00 0.00 H new ATOM 0 HG23 VAL A 58 10.448 -0.652 -11.740 1.00 0.00 H new ATOM 1946 N SER A 59 13.001 2.919 -9.197 1.00 0.00 N ATOM 1947 CA SER A 59 13.362 4.301 -8.752 1.00 0.00 C ATOM 1948 C SER A 59 13.854 5.089 -9.966 1.00 0.00 C ATOM 1949 O SER A 59 14.841 5.797 -9.907 1.00 0.00 O ATOM 1950 CB SER A 59 14.456 4.241 -7.685 1.00 0.00 C ATOM 1951 OG SER A 59 15.537 3.454 -8.165 1.00 0.00 O ATOM 0 H SER A 59 13.759 2.237 -9.158 1.00 0.00 H new ATOM 0 HA SER A 59 12.490 4.792 -8.320 1.00 0.00 H new ATOM 0 HB2 SER A 59 14.802 5.247 -7.445 1.00 0.00 H new ATOM 0 HB3 SER A 59 14.059 3.812 -6.765 1.00 0.00 H new ATOM 0 HG SER A 59 16.241 3.415 -7.484 1.00 0.00 H new ATOM 1957 N SER A 60 13.171 4.957 -11.071 1.00 0.00 N ATOM 1958 CA SER A 60 13.583 5.676 -12.308 1.00 0.00 C ATOM 1959 C SER A 60 13.571 7.182 -12.051 1.00 0.00 C ATOM 1960 O SER A 60 14.425 7.904 -12.523 1.00 0.00 O ATOM 1961 CB SER A 60 12.607 5.341 -13.437 1.00 0.00 C ATOM 1962 OG SER A 60 13.038 5.976 -14.634 1.00 0.00 O ATOM 0 H SER A 60 12.338 4.376 -11.169 1.00 0.00 H new ATOM 0 HA SER A 60 14.589 5.367 -12.592 1.00 0.00 H new ATOM 0 HB2 SER A 60 12.557 4.262 -13.582 1.00 0.00 H new ATOM 0 HB3 SER A 60 11.603 5.674 -13.176 1.00 0.00 H new ATOM 0 HG SER A 60 12.416 5.762 -15.360 1.00 0.00 H new ATOM 1968 N LYS A 61 12.606 7.658 -11.302 1.00 0.00 N ATOM 1969 CA LYS A 61 12.524 9.123 -11.000 1.00 0.00 C ATOM 1970 C LYS A 61 12.555 9.330 -9.489 1.00 0.00 C ATOM 1971 O LYS A 61 12.019 8.548 -8.730 1.00 0.00 O ATOM 1972 CB LYS A 61 11.220 9.689 -11.563 1.00 0.00 C ATOM 1973 CG LYS A 61 11.302 9.702 -13.091 1.00 0.00 C ATOM 1974 CD LYS A 61 9.990 10.229 -13.694 1.00 0.00 C ATOM 1975 CE LYS A 61 9.948 11.762 -13.636 1.00 0.00 C ATOM 1976 NZ LYS A 61 11.178 12.328 -14.262 1.00 0.00 N ATOM 0 H LYS A 61 11.867 7.092 -10.884 1.00 0.00 H new ATOM 0 HA LYS A 61 13.370 9.636 -11.457 1.00 0.00 H new ATOM 0 HB2 LYS A 61 10.375 9.083 -11.236 1.00 0.00 H new ATOM 0 HB3 LYS A 61 11.054 10.698 -11.186 1.00 0.00 H new ATOM 0 HG2 LYS A 61 12.134 10.329 -13.411 1.00 0.00 H new ATOM 0 HG3 LYS A 61 11.500 8.696 -13.459 1.00 0.00 H new ATOM 0 HD2 LYS A 61 9.899 9.896 -14.728 1.00 0.00 H new ATOM 0 HD3 LYS A 61 9.141 9.815 -13.150 1.00 0.00 H new ATOM 0 HE2 LYS A 61 9.063 12.130 -14.155 1.00 0.00 H new ATOM 0 HE3 LYS A 61 9.871 12.093 -12.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 10.960 13.255 -14.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 11.916 12.439 -13.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 11.517 11.685 -15.006 1.00 0.00 H new ATOM 1990 N GLY A 62 13.180 10.385 -9.051 1.00 0.00 N ATOM 1991 CA GLY A 62 13.248 10.652 -7.593 1.00 0.00 C ATOM 1992 C GLY A 62 13.972 11.976 -7.350 1.00 0.00 C ATOM 1993 O GLY A 62 13.702 12.672 -6.391 1.00 0.00 O ATOM 0 H GLY A 62 13.646 11.073 -9.642 1.00 0.00 H new ATOM 0 HA2 GLY A 62 12.243 10.692 -7.173 1.00 0.00 H new ATOM 0 HA3 GLY A 62 13.772 9.841 -7.088 1.00 0.00 H new ATOM 1997 N LYS A 63 14.897 12.329 -8.217 1.00 0.00 N ATOM 1998 CA LYS A 63 15.658 13.609 -8.054 1.00 0.00 C ATOM 1999 C LYS A 63 15.427 14.508 -9.274 1.00 0.00 C ATOM 2000 O LYS A 63 15.497 14.072 -10.405 1.00 0.00 O ATOM 2001 CB LYS A 63 17.148 13.290 -7.937 1.00 0.00 C ATOM 2002 CG LYS A 63 17.407 12.560 -6.618 1.00 0.00 C ATOM 2003 CD LYS A 63 18.868 12.095 -6.556 1.00 0.00 C ATOM 2004 CE LYS A 63 19.811 13.304 -6.600 1.00 0.00 C ATOM 2005 NZ LYS A 63 20.038 13.706 -8.016 1.00 0.00 N ATOM 0 H LYS A 63 15.157 11.779 -9.036 1.00 0.00 H new ATOM 0 HA LYS A 63 15.315 14.125 -7.157 1.00 0.00 H new ATOM 0 HB2 LYS A 63 17.466 12.672 -8.776 1.00 0.00 H new ATOM 0 HB3 LYS A 63 17.733 14.209 -7.978 1.00 0.00 H new ATOM 0 HG2 LYS A 63 17.191 13.220 -5.778 1.00 0.00 H new ATOM 0 HG3 LYS A 63 16.739 11.703 -6.530 1.00 0.00 H new ATOM 0 HD2 LYS A 63 19.038 11.525 -5.642 1.00 0.00 H new ATOM 0 HD3 LYS A 63 19.081 11.428 -7.391 1.00 0.00 H new ATOM 0 HE2 LYS A 63 19.381 14.134 -6.040 1.00 0.00 H new ATOM 0 HE3 LYS A 63 20.760 13.056 -6.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 21.059 13.788 -8.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 19.632 12.988 -8.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 19.581 14.623 -8.194 1.00 0.00 H new ATOM 2019 N LYS A 64 15.148 15.767 -9.044 1.00 0.00 N ATOM 2020 CA LYS A 64 14.905 16.720 -10.172 1.00 0.00 C ATOM 2021 C LYS A 64 16.208 17.446 -10.538 1.00 0.00 C ATOM 2022 O LYS A 64 16.869 17.111 -11.502 1.00 0.00 O ATOM 2023 CB LYS A 64 13.838 17.736 -9.732 1.00 0.00 C ATOM 2024 CG LYS A 64 13.549 18.770 -10.837 1.00 0.00 C ATOM 2025 CD LYS A 64 12.887 18.107 -12.053 1.00 0.00 C ATOM 2026 CE LYS A 64 12.326 19.195 -12.971 1.00 0.00 C ATOM 2027 NZ LYS A 64 11.786 18.575 -14.214 1.00 0.00 N ATOM 0 H LYS A 64 15.077 16.180 -8.114 1.00 0.00 H new ATOM 0 HA LYS A 64 14.558 16.176 -11.050 1.00 0.00 H new ATOM 0 HB2 LYS A 64 12.918 17.210 -9.475 1.00 0.00 H new ATOM 0 HB3 LYS A 64 14.174 18.250 -8.831 1.00 0.00 H new ATOM 0 HG2 LYS A 64 12.899 19.553 -10.446 1.00 0.00 H new ATOM 0 HG3 LYS A 64 14.478 19.251 -11.142 1.00 0.00 H new ATOM 0 HD2 LYS A 64 13.613 17.498 -12.591 1.00 0.00 H new ATOM 0 HD3 LYS A 64 12.089 17.439 -11.729 1.00 0.00 H new ATOM 0 HE2 LYS A 64 11.539 19.747 -12.457 1.00 0.00 H new ATOM 0 HE3 LYS A 64 13.108 19.912 -13.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 11.406 19.317 -14.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 12.547 18.067 -14.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 11.027 17.908 -13.968 1.00 0.00 H new ATOM 2041 N ARG A 65 16.570 18.452 -9.781 1.00 0.00 N ATOM 2042 CA ARG A 65 17.817 19.223 -10.078 1.00 0.00 C ATOM 2043 C ARG A 65 18.419 19.733 -8.765 1.00 0.00 C ATOM 2044 O ARG A 65 17.755 20.383 -7.982 1.00 0.00 O ATOM 2045 CB ARG A 65 17.461 20.410 -10.982 1.00 0.00 C ATOM 2046 CG ARG A 65 18.719 21.223 -11.313 1.00 0.00 C ATOM 2047 CD ARG A 65 18.343 22.398 -12.220 1.00 0.00 C ATOM 2048 NE ARG A 65 18.134 21.900 -13.610 1.00 0.00 N ATOM 2049 CZ ARG A 65 17.534 22.650 -14.494 1.00 0.00 C ATOM 2050 NH1 ARG A 65 17.150 23.854 -14.176 1.00 0.00 N ATOM 2051 NH2 ARG A 65 17.327 22.196 -15.700 1.00 0.00 N ATOM 0 H ARG A 65 16.051 18.774 -8.964 1.00 0.00 H new ATOM 0 HA ARG A 65 18.543 18.585 -10.581 1.00 0.00 H new ATOM 0 HB2 ARG A 65 17.000 20.050 -11.902 1.00 0.00 H new ATOM 0 HB3 ARG A 65 16.728 21.047 -10.486 1.00 0.00 H new ATOM 0 HG2 ARG A 65 19.179 21.590 -10.396 1.00 0.00 H new ATOM 0 HG3 ARG A 65 19.455 20.589 -11.807 1.00 0.00 H new ATOM 0 HD2 ARG A 65 17.436 22.879 -11.854 1.00 0.00 H new ATOM 0 HD3 ARG A 65 19.132 23.150 -12.206 1.00 0.00 H new ATOM 0 HE ARG A 65 18.461 20.970 -13.871 1.00 0.00 H new ATOM 0 HH11 ARG A 65 17.318 24.211 -13.236 1.00 0.00 H new ATOM 0 HH12 ARG A 65 16.681 24.439 -14.868 1.00 0.00 H new ATOM 0 HH21 ARG A 65 17.634 21.256 -15.951 1.00 0.00 H new ATOM 0 HH22 ARG A 65 16.858 22.781 -16.392 1.00 0.00 H new ATOM 2065 N ARG A 66 19.669 19.444 -8.509 1.00 0.00 N ATOM 2066 CA ARG A 66 20.303 19.916 -7.239 1.00 0.00 C ATOM 2067 C ARG A 66 21.810 20.081 -7.445 1.00 0.00 C ATOM 2068 O ARG A 66 22.222 20.196 -8.588 1.00 0.00 O ATOM 2069 CB ARG A 66 20.049 18.893 -6.123 1.00 0.00 C ATOM 2070 CG ARG A 66 18.561 18.902 -5.747 1.00 0.00 C ATOM 2071 CD ARG A 66 18.320 18.047 -4.492 1.00 0.00 C ATOM 2072 NE ARG A 66 16.928 17.485 -4.521 1.00 0.00 N ATOM 2073 CZ ARG A 66 15.890 18.234 -4.807 1.00 0.00 C ATOM 2074 NH1 ARG A 66 16.002 19.529 -4.887 1.00 0.00 N ATOM 2075 NH2 ARG A 66 14.717 17.680 -4.954 1.00 0.00 N ATOM 2076 OXT ARG A 66 22.526 20.092 -6.457 1.00 0.00 O ATOM 0 H ARG A 66 20.278 18.903 -9.123 1.00 0.00 H new ATOM 0 HA ARG A 66 19.869 20.875 -6.957 1.00 0.00 H new ATOM 0 HB2 ARG A 66 20.345 17.898 -6.454 1.00 0.00 H new ATOM 0 HB3 ARG A 66 20.657 19.133 -5.250 1.00 0.00 H new ATOM 0 HG2 ARG A 66 18.231 19.925 -5.567 1.00 0.00 H new ATOM 0 HG3 ARG A 66 17.967 18.517 -6.576 1.00 0.00 H new ATOM 0 HD2 ARG A 66 19.048 17.237 -4.447 1.00 0.00 H new ATOM 0 HD3 ARG A 66 18.460 18.652 -3.596 1.00 0.00 H new ATOM 0 HE ARG A 66 16.786 16.497 -4.313 1.00 0.00 H new ATOM 0 HH11 ARG A 66 16.906 19.974 -4.726 1.00 0.00 H new ATOM 0 HH12 ARG A 66 15.186 20.099 -5.110 1.00 0.00 H new ATOM 0 HH21 ARG A 66 14.612 16.671 -4.846 1.00 0.00 H new ATOM 0 HH22 ARG A 66 13.905 18.256 -5.176 1.00 0.00 H new TER 2090 ARG A 66 HETATM 2091 ZN ZN A 67 -12.055 3.118 2.131 1.00 0.00 ZN